Benzyl Alcohol 苯甲醇

CAS 100-51-6 MFCD00004599

化学结构图

100-51-6
SMILES: OCc1ccccc1

化学属性

Mol. FormulaC7H8O
Mol. Weight108.14
Density1.045
Refractive index1.5380 to 1.5430
Boiling Point203-205°C at 760 mmHg
Melting Point-15.3°C
Flash Point93.89°C
TSCAYes
Autoignition Point817 °F
Vapor Density3.7 (vs air)
Vapor Pressure13.3 mmHg ( 100 °C)
Solubility溶于水,易溶于醇、醚、芳烃。
pH:A

别名和识别编码

Chemical NameBenzyl Alcohol
Synonym Benzyl alcohol {LY} Benzyl alcohol {} {LY} Benzyl alcohol {} {} {LY} Benzyl alcohol {} {} {} {LY} Benzyl alcohol {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Benzy
CAS Number100-51-6
EC Number202-859-9
Beilstein Registry Number878307
MDL NumberMFCD00004599
Reaxys-RN878307
PubChem Substance ID87565187
Merck Number1124
Chemical Name Translation苯甲醇
Wiswesser Line NotationQ1R
LabNetwork Molecule IDLN00163691
InChIInChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
Canonical SMILESOCC1=CC=CC=C1
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分类

  • {SNA} 2009/48/EC (Directive on the Safety of Toys), A - D, A-F, Additional Standards, Alcoholic & Nonalcoholic Beverages, Alcohols, Alcohols and Phenols, Alphabetical, Analytical Standards, Antioxidants & Preservatives, Beans, Certified Reference Materials (CRMs), Cranberry, E numbers (Food Additives), E1000–E1599 (additional chemicals), E1519,
  • {SNA} A - D, A-B, A-D, Alphabetical Listings, Certified Food Grade Products, Certified Natural Products, Flavors and Fragrances, Halal Certified Products, Kosher Certified Products
  • {SNA} A -

产品应用

  • 有机合成,明胶、干酪素(热时)、乙酸纤维素及虫胶等的溶剂,显微镜用包埋材料,测维生素B12的含量。

相关文献及参考

  • Short: II/25D
  • Merck:14,1124 Beilstein:6(4)2222
  • Merck:14,1124
  • Short: II/27B

安全信息

GHS Symbol
WGK Germany1
Hazard Codes 9
Hazard statements
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H302+H312+H332
  • H302+H332
  • H319 Causes serious eye irritation 严重刺激眼睛
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSDN3150000
Signal word Warning
Safety Statements
  • 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;
Risk Statements
  • R20/22 Harmful by inhalation and if swallowed 吸入和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • 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。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • 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。
  • P301+P312
  • P301+P312+P330
  • P302+P352+P312+P362+P364
  • P304+P340
  • P304+P340+P312
  • P305+P351+P338
  • P313 Get medical advice/attention. 获取医疗咨询/就医
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Packing GroupIII
UN Number 3334
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 r
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NPIRI* Raw Material Data Handbook, Vol.1: Organic Solvents, 1974. (National
   Assoc. of Printing Ink Research Institute, Francis McDonald Sinclair
   Memorial Labor

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 650 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
   Behavioral - somnolence (general depressed activity)
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   JPMSAE Journal of Pharmaceutical Sciences.  (American Pharmaceutical Assoc.,
   2215 Constitution Ave., NW, Washington, DC 20037)  V.50-    1961-
   Volume(issue)/page/year: 75,702,1986

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 10 gm/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - muscle weakness
   Gastrointestinal - changes in structure or function of salivary glands
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - cat
DOSE/DURATION           : 625 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 16,1,1920

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 4 ug/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-343,1989

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Bacillus subtilis
DOSE/DURATION           : 21 mg/disc
REFERENCE :
   OIGZDE Osaka-shi Igakkai Zasshi.  Journal of Osaka City Medical Association.
    (Osaka-shi Igakkai, c/o Osaka-shiritsu Daigaku Igakubu, 1-4-54 Asahi-cho,
   Abeno-ku, Osaka, 545, Japan) V.24-    1975- Volume(issue)/page/year:
   34,267,1985

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Rodent - mouse Lymphocyte
DOSE/DURATION           : 250 mg/L
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-343,1989

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 10 mmol/L
REFERENCE :
   EMMUEG Environmental and Molecular Mutagenesis.  (Alan R. Liss, Inc., 41 E.
   11th St., New York, NY 10003)  V.10-    1987-  Volume(issue)/page/year:
   24,181,1994

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 6 gm/kg
SEX/DURATION            : female 6-13 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight
   gain)
REFERENCE :
   TCMUD8 Teratogenesis, Carcinogenesis, and Mutagenesis.  (Alan R. Liss, Inc.,
   41 E. 11th St., New York, NY 10003)  V.1-    1980- Volume(issue)/page/year:
   7,29,1987

其他信息

  • FEMA:2137
  • 方法三:以氯化苄为原料,在碱的催化作用下加热水解而得。香料级苄醇的规格(QB792-81):相对密度1.041-1.046,折光率1.538-1.541,沸程203-206℃馏出量在95%以上,溶解度全溶于30倍容量的蒸馏水中,含醇量≥98%,含氯试验(N.F)为副反应。原料消耗定额:氯化苄1600kg/t、纯碱1000kg/t。
  • 下游产品:磷酸精胺酸 --> 苯甲酸苄酯 --> 2-醛基-5-苄氧基-1氢-吡咯[3,2-B]吡啶 --> 3-氨基-5-氟吡啶 --> 2-羟基-4,6-二氨基嘧啶 --> O-6-苄基鸟嘌呤 --> 乙酸苄酯 --> 乙氰菊酯 --> 3-氨基-5-羟基吡啶 --> 5-苯甲氧基吡啶-3-胺 --> 二苯基N,N'-二异丙基亚磷酰胺 --> 甲酸苄酯 --> 4-苄氧基吡啶 N-氧化物 --> 5-溴-2-氯-4-(苯基甲氧基)-嘧啶 --> 6-苄胺基嘌呤 --> 4-苄氧基-2-氯嘧啶,95% --> 6-苄氧基嘌呤 --> 4-苄氧基-2(1H)-吡啶酮 --> 织物斑点清除 --> 3-苯甲氧基-5-溴吡啶 --> 2,4-二苄氧基-5-溴嘧啶 --> 偶氮苯 --> 胍立莫司 --> 肉桂酸苄酯 --> 异丁酸苄酯 --> 丙酸苄酯 --> 氯乙酸苄酯 --> 苄醚 --> 盐酸去氧肾上腺素 --> Α-甲基苄基乙酸酯 --> 双苯甲醇-β-氯乙基醚 --> 苯磺酸甲酯 --> 苯海拉明 --> 丁酸苯甲酯 --> (E)-2-甲基-2-丁烯酸苯甲酯 --> 苄基正丁基醚 --> Α-羟基苯丁酸苯基甲基酯 --> 3-甲基丁酸苯甲酯
  • 微有芳香气味,灼烧味。可燃,自燃点436℃。久贮可受空气中氧化而成苯甲醛,故有苦杏仁气味。易溶于丙酮,溶于醇、醚及氯仿,微溶于水(1份苯甲醇可溶于40份水)。有刺激性。天然存在于素馨花香油;伊兰伊兰油;月下香油等物质中,以游离态或酯类形式存在。
  • 蒸气压:13.3 mm Hg ( 100 °C)
  • 刺激数据:
  • 作用与用途:苯甲醇用作药膏的防腐剂,纤维、尼龙丝及塑料薄膜的干燥剂,聚氯乙烯的稳定剂,照相显影剂,醋酸纤维、墨水、涂料、油漆、环氧树脂涂 料、染料、酪蛋白、虫胶及明胶等的溶剂,制取苄基酯或醚的中间体。也用于制取香料和调味剂(多数为脂肪酸的苯甲醇酯),以作为肥皂、 香水、化妆品和其他产品中的添加剂。由于与石英和羊毛纤维具有几乎相同的折射率,因此用作石英和羊毛纤维的鉴别剂。香料工业中用作定 香剂和稀释剂 苯甲醇的羟基很活泼,它可以与苯反应生成二苯甲烷,与丙烯腈反应生成N-苄基丙烯酰胺(Ritter反应),也可以与卤化磷和氢卤酸反应生成 卤化苄。卤化苄和苯甲醇都是苄基(苯甲基)化试剂,用于给羧酸和醇羟基上苄基保护基。苄基保护基很容易通过氢化脱去。此外,苯甲醇也 容易被多种氧化剂氧化成苯甲酸,如果用硝酸氧化,随浓度和温度不同,可生成醛或酸。 在注射青霉素的时候,为了防止患者疼痛感过强,常常用苯甲醇进行麻醉,这样打起来疼痛感就不会过于强烈,故苯甲醇又被称为“无痛水” 。然而,临床上很快发现一种普遍的副作用:臀肌挛缩症。这是因为苯甲醇不易被人体吸收,长期积留在注射部位,会导致周围肌肉的坏死, 严重者,甚至影响骨骼的发育。2005年,国家药监局发文禁止苯甲醇作为青霉素溶剂注射使用。
  • 爆炸物危险特性:180℃时, 与硫酸混合分解爆炸; 100℃以上,为溴化氢和铁催化聚合发热
  • 上游原料:甲苯 --> 碳酸钾 --> 碳酸钠 --> 氯 --> 苄基氯
  • 毒性分级:中毒
  • 方法二:苯
  • 防护措施:低毒,但大量附着在皮肤上时具有较强的毒性。大鼠经口LD50为3100mg/kg。生产设备要密闭,防止跑、冒、滴、漏。操作人员要穿戴防护用具。
  • 类别:易燃液体
  • 灭火剂:干粉、泡沫、砂土、水
  • 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量(g/kg) 最大允许残留量(g/kg) 苯甲醇 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
  • 用途一:用于制备花香油和

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