CAS 5273-86-9 MFCD00009281-beta-Asarone β-细辛醚 TAO{mole}

beta-Asarone β-细辛醚

CAS 5273-86-9 MFCD00009281

化学结构图

SMILES: CC=Cc1cc(OC)c(OC)cc1OC

化学属性

Mol. Formula	C12H16O3
Mol. Weight	208.25
Refractive index	n20/D 1.558(lit.)
Density	1.073 g/mL at 25 °C(lit.)
Flash Point	107.7°C
Boiling Point	296°C at 760 mmHg

别名和识别编码

Chemical Name	(Z)-1,2,4-Trimethoxy-5-(Prop-1-En-1-Yl)Benzene
MDL Number	MFCD00009281
CAS Number	5273-86-9
Synonym	(E)-asarone (Z)-1,2,4-Trimethoxy-5-(1-propenyl)benzene (Z)-5-Propenyl-1,2,4-trimethoxybenzene (Z)-Asarone (Z)-Asarone; cis-Asarone; cis-Isoasarone (Z)-asarone (z)-1,2,4-trimethoxy-5-(1-propenyl)benzene 1,2,4-TRIMETHOXY-5-((Z)-1-PROPENYL)BENZENE 1,2,4-trimethoxy-5-propenylbenzene, z- 2,4,5-Trimethoxy-1-propenylbenzene 2,4,5-trimethoxypropen-1-ylbenzene 2,4,5-三甲氧基-1-丙烯基苯 2,4-trimethoxy-5-(1-propenyl)-(z)-benzen 2,4-trimethoxy-5-propenyl-(z)-benzen ASARONE, B- B-ASARONE BETA-ASARONE BETA-ASARONE (PHENOL DERIVATIVE) BETA-细辛脑 Benzene, 1,2,4-trimethoxy-5-(1-propenyl)-, (Z)- Benzene, 1,2,4-trimethoxy-5-propenyl-, (Z)- Beta-asarone CIS-2,4,5-TRIMETHOXY-1-PROPENYLBENZE
EC Number	226-096-6
Beilstein Registry Number	1910605
PubChem Substance ID	5281758
Chemical Name Translation	β-细辛醚
LabNetwork Molecule ID	LN01280847
InChI	InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5-
Canonical SMILES	C/C=C\C1=C(OC)C=C(OC)C(OC)=C1

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安全信息

GHS Symbol

WGK Germany3

Hazard statements

H302 Harmful if swallowed 吞食有害
H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。

Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

RTECSDC3000000

Signal word Warning

Safety Statements

S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；

Hazard Codes Xn

Risk Statements

R22 Harmful if swallowed 吞咽有害

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 52 mg/kg
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Liver - tumors
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   47,2275,1987

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 107 mg/L
REFERENCE :
   PLMEAA Planta Medica.  (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart
   1, Fed. Rep. Ger.) V.1-    1953-  Volume(issue)/page/year: 53,251,1987

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 107 mg/L
REFERENCE :
   PLMEAA Planta Medica.  (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart
   1, Fed. Rep. Ger.) V.1-    1953-  Volume(issue)/page/year: 53,251,1987

TYPE OF TEST            : Unscheduled DNA synthesis
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 500 umol/L
REFERENCE :
   FCTOD7 Food and Chemical Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.20-    1982- Volume(issue)/page/year:
   32,223,1994

Storage condition 2-8°C, protect from light

Precautionary statements

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。
P273 Avoid release to the environment. 避免释放到环境中。
P301+P312
P301+P317
P330 Rinse mouth. 漱口
P501 Dispose of contents/container to..… 处理内容物/容器.....

其他信息

可燃性危险特性:可燃; 燃烧产生刺激烟雾
毒性分级:高毒
用途一:平喘、化痰、止咳。
储运特性:通风低温干燥
MOL 文件:5273-86-9.mol
Sigma Aldrich:5273-86-9(sigmaaldrich)
急性毒性:参考值：口服-小鼠 LD50： 418 毫克/公斤；腹腔-小鼠 LD50： 310 毫克/公斤
灭火剂:干粉,泡沫,沙土,二氧化碳, 雾状水
类别:有毒物品