CAS 91-20-3 MFCD00001742-Naphthalene 萘 -LabNovo

Naphthalene 萘

CAS 91-20-3 MFCD00001742

化学结构图

SMILES: c1ccc2ccccc2c1

化学属性

Mol. Formula	C10H8
Mol. Weight	128.17
Boiling Point	-
Melting Point	79 - 82°C
Density	0.99
Refractive index	1.5898
Flash Point	78.89°C
TSCA	Yes
Solubility	Soluble in benzene, toluene, chloroform, CS2, ether. Insoluble in water
Autoignition Point	978 °F
Vapor Density	4.4 (vs air)
Vapor Pressure	0.03 mmHg ( 25 °C)
Stability	对湿度敏感

别名和识别编码

Chemical Name	Naphthalene
CAS Number	91-20-3
PubChem Substance ID	125307500
EC Number	202-049-5
Beilstein Registry Number	1421310
MDL Number	-
Reaxys-RN	1421310
Merck Number	6370
Synonym	Naphthalene {LY} Naphthalene {} {LY} Naphthalene {} {} {LY} Naphthalene {} {} {} {LY} Naphthalene {} {} {} {} {LY} Naphthalene {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Naphthalene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation	萘
Wiswesser Line Notation	L66J
LabNetwork Molecule ID	LN00194168
InChI	InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H
Canonical SMILES	C12=CC=CC=C1C=CC=C2

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分类

{SNA} All PAH Standards, Alpha Sort, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chemical Class, Chromatography, Environmental Standards, Fumigants, Hydrocarbons, Insecticides, N, N-O, NA - NI, Naphthalenes, Neats and Solutions, PAHs, Standards for Personal Care and Cosmetic Products, Volatiles/ Semivolatiles, prohibited substances (EU-REGULATION No 1223/2009), solutions, 农残和代谢标准品, 农残标准品
{SNA} Additional Standards, Alpha Sort, Analytical Standar

产品应用

有机分析中作难溶性染料结晶的溶剂。测定分子量。比色法标准。有机微量分析测定碳和氢的标准。液体闪烁计数中晶体有机闪烁剂。校正温度计。

安全信息

GHS Symbol

WGK Germany3

Hazard Codes 4.1 F,Xn,N Xn;N

Hazard statements

H351 Suspected of causing cancer 怀疑致癌
H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
H302 Harmful if swallowed 吞食有害
H228 Flammable solid 易燃固体
H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
H315 Causes skin irritation 会刺激皮肤
H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
H336 May cause drowsiness or dizziness 肯能导致嗜睡或头晕

Personal Protective Equipment Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

RTECSQJ0525000

Precautionary statements

P201 Obtain special instructions before use. 使用前获取专门指示。
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
P233 Keep container tightly closed. ?保持容器密闭。
P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
P273 Avoid release to the environment. 避免释放到环境中。
P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P281 Use personal protective equipment as required. 使用所需的个人防护装备。
P301+P312
P301+P312+P330
P302+P350
P302+P352+P333+P313+P362+P364
P303+P361+P353
P305+P351+P338
P305+P351+P338+P337+P313
P308+P311
P337+P313
P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Signal word Danger Warning

UN Number 1334

Risk Statements

R11 Highly flammable 非常易燃
R20 Harmful by inhalation 吸入有害
R22 Harmful if swallowed 吞咽有害
R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有毒
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
R38 Irritating to skin 刺激皮肤
R39/23/24/25 Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 毒性：吸入，皮肤接触和吞食都会产生十分严重的不可逆危险
R40 Limited evidence of a carcinogenic effect 有限证据表明其致癌作用
R50/53
R52/53
R65 Harmful: may cause lung damage if swallowed 若吞咽可能伤害肺部器官
R67 Vapours may cause drowsiness and dizziness 蒸汽可能导致嗜睡和昏厥

Safety Statements

S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
S46 If swallowed, seek medical advice immediately and show this container or label 食入时，立即求医并出示容器/标签；
S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
S62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label where possible 吞食后不要催吐：立即求医并出示该容器或标签；
S7 Keep container tightly closed 保存在严格密闭容器中；

Packing GroupIII

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

Hazard Class4.1

Warnings 危化品目录(2015)

TYPE OF TEST            : TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 30 ppm/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Lungs, Thorax, or Respiration - tumors
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-410,1992

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3500 mg/kg/12W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Blood - lymphoma, including Hodgkin's disease
   Reproductive - Tumorigenic effects - uterine tumors
REFERENCE :
   APAVAY Virchows Archiv fuer Pathologische, Anatomie und Physiologie, und
   fuer Klinische Medizin. (Berlin, Ger.)  V.1-343, 1847-1967.  For publisher
   information, see VAAPB7.  Volume(issue)/page/year: 329,141,1956

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 1200 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - changes in motor activity (specific assay)
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 47(11),78,1982

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >340 mg/m3/1H
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - lacrimation
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   BIOFX* BIOFAX Industrial Bio-Test Laboratories, Inc., Data Sheets.  (1810
   Frontage Rd., Northbrook, IL 60062)  Volume(issue)/page/year: 16-4/1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 490 mg/kg
TOXIC EF

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 150 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD691-490

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Human - man
DOSE/DURATION           : 74 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   8

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 30 mg/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-410,1992

TYPE OF TEST            : Specific locus test
ROUTE OF EXPOSURE       : Oral
TEST SYSTEM             : Insect - Drosophila melanogaster
DOSE/DURATION           : 5 mmol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 341,235,1995

TYPE OF TEST            : Micronucleus test
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 30 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 393,23,1997

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 15 mg/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-410,1992

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 4500 mg/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
   Reproductive - Specific Developmental Abnormalities - other developmental
   abnormalities
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: PB92-135623

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 5925 mg/kg
SEX/DURATION            : female 1-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
   Reproductive - Specific Developmental Abnormalities - cardiovascular
   (circulatory) system
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   48,A35,1979

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 2400 mg/kg
SEX/DURATION            : female 7-14 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - live birth index (measured after birth)
   Reproductive - Effects on Newborn - viability index (e.g., # alive at day 4
   per # born alive)
REFERENCE :
   JTEHD6 Journal of Toxicology and Environmental Health.  (Hemisphere Pub.,
   1025 Vermont Ave., NW, Washington, DC 20005)  V.1-    1975/76-
   Volume(issue)/page/year: 15,25,1985

Restrict 危险品

其他信息

蒸气压:0.03 mm Hg ( 25 °C)
灭火剂:水、泡沫、二氧化碳、干粉
用途一:合成医药、杀虫剂、香料、染料、橡胶防老剂
方法三:1.由煤焦油分离，高温煤焦油中萘约占8%-12%，将煤焦油蒸馏，切取煤油，经脱酚，脱喹啉，蒸馏得成品萘。每吨萘消耗10t煤焦油。2.由石油烃制得：催化重质重整油，催化裂化轻循环油，裂解制乙烯的副产焦油等。其组成如下：项目　　　　　　催化重整油　催化裂化轻循环油　蒸汽裂解副产品　煤焦油芳烃总量（m），% 90-95 45-65 70-95 95-100芳烃组成（m），% 烷基苯类　　　　20 25 20 5　二氢茚和四氢萘　15　　　　　25　　　　　　　　10　　　　　　　5　烷基茚　　　　　2　　　　　 7 18 3 烷基萘类　　　　55　　　　　35　　　　　　　　45　　　　　　　75　联苯和烷基类　　6　　　　　 6 5 10　三环化合物　　　2　　　　　 2 2 2 总计，%　　　　 100　 100 100 100　以上芳烃经催化脱烷基和热解脱烷基均可以生产萘。
用途六:萘是农药生产中的一种原料，可以制造成甲萘酚、乙萘酚，也可以氧化成苯二甲酸酐，进一步生成苯二甲酰亚胺，也可以与氯乙酸生成萘乙酸。可作为杀虫剂亚胺硫磷、甲萘威，除草剂灭草松、敌草胺，植物生长调节剂萘乙酸和萘氧乙酸等的中间体。
外观性质:白色易挥发晶体，有温和芳香气味，粗萘有煤焦油臭味。
稠环芳香烃:萘由两个苯环构成的最简单的稠环芳香烃，俗称“卫生球”。是煤焦油加工的主要产品之一。萘在工业上以粗萘(工业萘和压榨萘)和精萘等产品形式出现。萘的分子式为C10H8，分子量为128.17。熔点为80.28℃，固态密度为1.145g/cm3，液态密度(85℃)为0.9752g/cm3，比热容(100℃)为1809J/(kg·K)，折射率(85℃)为1.5898。萘为无色单斜晶体，易挥发、升华，有特殊气味，易燃，能与空气形成爆炸性混合物;其石油醚溶液在汞灯下呈红紫色荧光，几乎不溶于水，能溶于醚、醇、苯等类溶剂。萘蒸气和粉尘吸入人体内或通过皮肤吸收都能使人中毒，空气中极限允许浓度为20mg/m3。萘是染料、塑料、油漆、医药和农药等工业的基本原料之一，曾直接作为衣物、皮毛防蛀的卫生球使用。萘比苯容易发生取代反应——卤代、硝化、磺化和傅氏反应。α-碳原子上的电子密度较高，生成α-取代产物的速率较快; β-取代产物稳定性较大。取代反应中α-和β-取代产物的比例决定于试剂的性质、催化剂、溶剂、温度等因素。如卤代和硝化反应是不可逆的，一般主要生成α-取代产物，其中溴代反应不需要催化剂就能发生。磺化反应是可逆的，温度较低时，主产物为α-萘磺酸，温度较高时，主产物为β-萘磺酸，当温度升高时，α-萘磺酸可以转变为更稳定的β-萘磺酸：以上信息由Chemicalbook的晓楠编辑整理。
类别:易燃固体
图谱信息:萘(91-20-3)质谱(MS) 萘(91-20-3)核磁图( 13 CNMR) 萘(91-20-3)核磁图( 1 HNMR) 萘(91-20-3)Raman光谱萘(91-20-3)红外图谱(IR1) 萘(91-20-3)红外图谱(IR2)
Alfa Aesar:萘,99+% Naphthalene, 99+%(91-20-3)
上游原料:石脑油，原油 --> 联苯 --> 高岭土 --> 焦油 --> 焦油 --> 茚 --> 乙烯 --> 1,2,3,4-四氢萘 --> 正十二烷基苯 --> 苯酐用萘 --> 环化合物 --> 酚油
萘熔融-结晶精制:利用熔融的粗萘在冷却结晶时发生组分在液固两相间重新分布的原理，经过多次熔融结晶来提纯萘的工艺过程。是对萘油馏分加工得到的粗萘进行精制的工艺之一。粗萘中的杂质一般会降低萘的熔点，所以当液态粗萘缓慢冷却时萘首先结晶析

Naphthalene 萘

CAS 91-20-3 MFCD00001742

化学结构图

化学属性

别名和识别编码

分类

产品应用

相关文献及参考

安全信息

其他信息

系列性分类

相关产品推荐

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链接

搜索结果

化学结构图

化学属性

别名和识别编码

分类

产品应用

相关文献及参考

安全信息

其他信息

系列性分类

相关产品推荐

Products Indices

Mailings

Contact

链接