CAS 84-79-7 MFCD00001679-2-Hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione 2-羟基-3-(3-甲基丁-2-烯-1-基)萘-1,4-二酮 -LabNovo

2-Hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione 2-羟基-3-(3-甲基丁-2-烯-1-基)萘-1,4-二酮

CAS 84-79-7 MFCD00001679

化学结构图

SMILES: CC(C)=CCC1=C(O)c2ccccc2C(=O)C1=O

化学属性

Mol. Formula	C₁₅H₁₄O₃
Mol. Weight	242.27
Melting Point	137-139°C
Boiling Point
Flash Point	-

别名和识别编码

Chemical Name	2-Hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione
Synonym	1,4-Naphthalenedione, 2-hydroxy-3-(3-methyl-2-butenyl)- 1,4-Naphthoquinone, 2-hydroxy-3-(3-methyl-2-butenyl)- 2-Hydroxy-3-(3-methyl-2-butenyl)-1,4-naphthalenedione 2-Hydroxy-3-(3-methyl-2-butenyl)-1,4-naphthoquinone 2-hydroxy-3-(3-methyl-2-butenyl)-1,4-naphtho-quinone 2-hydroxy-3-(3-methyl-but-2-enyl)-(1,4)naphthoquinone 2-羟基-3-(3-甲基-2-丁烯基)-1,4-萘醌 2-羟基-3-(3-甲基-2-丁烯基)-1,4-萘醌黄钟花醌 Bethabarra Wood Bethabarra wood C.I. 75490 C.I. Natural Yellow 16 Greenharten Greenhartin Ipe-tobacco Wood Lapachic acid Lapachol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
MDL Number	-
PubChem Substance ID	3884
CAS Number	84-79-7
EC Number	201-563-7
Chemical Name Translation	2-羟基-3-(3-甲基丁-2-烯-1-基)萘-1,4-二酮
Wiswesser Line Notation	L66 BV EVJ CQ D2UY1&1
Beilstein Registry Number	2051889
LabNetwork Molecule ID	LN01304014
Canonical SMILES	-
InChI	InChI=1S/C15H14O3/c1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18/h3-7,16H,8H2,1-2H3

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安全信息

Hazard statements

H302 Harmful if swallowed 吞食有害
H302+H312+H332
H312 Harmful in contact with skin 皮肤接触有害
H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛
H332 Harmful if inhaled 吸入有害
H335 May cause respiratory irritation 可能导致呼吸道刺激

WGK Germany3

GHS Symbol

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。
P264+P265
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。
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+P317
P302+P352
P304+P312
P304+P340
P305+P351+P338
P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
P317
P319
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
P330 Rinse mouth. 漱口
P332+P313
P332+P317
P337+P313
P337+P317
P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
P362+P364
P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
P403+P233
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Signal word Warning

Hazard Codes Xn

RTECSQL8750000

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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；
S36 Wear suitable protective clothing 穿戴适当的防护服；

Risk Statements

R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   17,1,1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 26,570,1983

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 487 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Gastrointestinal - hypermotility, diarrhea
   Skin and Appendages - dermatitis, other (after systemic exposure)
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   17,1,1970

Storage condition -20 -20°C 2-8°C, stored under nitrogen

2-Hydroxy-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione 2-羟基-3-(3-甲基丁-2-烯-1-基)萘-1,4-二酮

CAS 84-79-7 MFCD00001679

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