CAS 2883-98-9 MFCD00064457-(E)-1,2,4-Trimethoxy-5-(Prop-1-En-1-Yl)Benzene (E)-1,2,4-三甲氧基-5-(丙-1-烯-1-基)苯 TAO{mole}

(E)-1,2,4-Trimethoxy-5-(Prop-1-En-1-Yl)Benzene (E)-1,2,4-三甲氧基-5-(丙-1-烯-1-基)苯

CAS 2883-98-9 MFCD00064457

化学结构图

SMILES: C/C=C/c1cc(OC)c(OC)cc1OC

化学属性

Mol. Formula	C12 H16 O3
Mol. Weight	208.25
Boiling Point	296°C
Melting Point	57-61°C
Density	1.028

别名和识别编码

Chemical Name	(E)-1,2,4-Trimethoxy-5-(Prop-1-En-1-Yl)Benzene
Synonym	(E)-1,2,4-Trimethoxy-5-(1-propenyl)benzene; trans-1-Propenyl-2,4,5-trimethoxybenzene (E)-2,4,5-Trimethoxypropenylbenzene (E)-Asarone (E)-asarone (Z)-asarone (e)-1,2,4-trimethoxy-5-(1-propenyl)benzene 1,2,4-TRIMETHOXY-5-(1-PROPENYL)BENZENE 1,2,4-Trimethoxy-5-[(1E)-1-propenyl]benzene 1,2,4-trimethoxy-5-propenylbenzene, z- 2,4,5-TRIMETHOXYPROPENYL BENZENE 2,4,5-trimethoxypropen-1-ylbenzene 2,4-trimethoxy-5-(1-propenyl)-(e)-benzen 2,4-trimethoxy-5-propenyl-(e)-benzen 2,4-trimethoxy-5-propenyl-trans-benzen A-ASARONE ALPHA-ASARONE ALPHA-ASARONE (PHENOL DERIVATIVE) ALPHA-细辛醚(ALPHA-细辛脑) ASARONE ASARONE, A- Asaron Asarone Asarone, trans- Asarum camp
CAS Number	2883-98-9
PubChem Substance ID	636822
EC Number	220-743-6
Beilstein Registry Number	1910606
MDL Number	MFCD00064457
Chemical Name Translation	(E)-1,2,4-三甲氧基-5-(丙-1-烯-1-基)苯
Reaxys-RN	1910606
Wiswesser Line Notation	2U1R BO1 DO1 EO1 -T
LabNetwork Molecule ID	LN00194907
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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产品应用

本品具有止咳、祛痰、平喘、解痉、镇静、抗癫痫、降血脂、利脂等作用，对肺炎双球菌、金黄色葡萄球菌和大肠杆菌的生长有不同程度的抑制作用，并具有一定的抗癌活性。临床用于治疗慢性支气管炎、支气管哮喘、成人肺炎、慢性阻塞性肺疾病伴肺部急性炎症、癫痫大发作及高脂血症等。

安全信息

GHS Symbol

WGK Germany3

Hazard statements

H302 Harmful if swallowed 吞食有害

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

Hazard Codes Xn

RTECSDC2975000

Signal word Warning

Safety Statements

S22 Do not breathe dust 不要吸入粉尘；
S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；

Risk Statements

R22 Harmful if swallowed 吞咽有害

Storage condition +4°C -20°C 2-8°C 4℃

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。
P301+P312
P301+P312+P330
P330 Rinse mouth. 漱口
P501 Dispose of contents/container to..… 处理内容物/容器.....

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 156 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

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 176 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 310 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 48(6),17,1985

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Bird - wild bird species
DOSE/DURATION           : 750 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AECTCV Archives of Environmental Contamination and Toxicology.
   (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ
   070944)  V.1-    1973-  Volume(issue)/page/year: 12,355,1983

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 418 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 48(6),17,1985

TYPE OF TEST            : Sister chromatid exchange
ROUTE OF EXPOSURE       : Intraperitoneal
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 25 mg/kg
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 279,269,1992

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

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 60 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 279,269,1992

TYPE OF TEST            : Mutation test systems - not otherwise specified
ROUTE OF EXPOSURE       : Intraperitoneal
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 50 mg/kg
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 279,269,1992

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 150 mg/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
   JTCEEM Journal de Toxicologie Clinique et Experimentale.  (SPPIF, B.P.22,
   F-41353 Vineuil, France) V.5-    1985-  Volume(issue)/page/year: 12,149,1992

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 600 mg/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - craniofacial
   (including nose and tongue)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   JTCEEM Journal de Toxicologie Clinique et Experimentale.  (SPPIF, B.P.22,
   F-41353 Vineuil, France) V.5-    1985-  Volume(issue)/page/year: 12,149,1992

其他信息

Sigma Aldrich:2883-98-9(sigmaaldrich)
MSDS 信息:trans-1-Propenyl-2,4,5-trimethoxybenzene(2883-98-9).msds
MOL 文件:2883-98-9.mol
几乎不溶于水，溶于乙醇、乙醚、冰醋酸、四氯化碳、氯仿、石油醚。
外观性质:针状结晶(石油醚)。几乎不溶于水，溶于乙醇、乙醚、冰醋酸、四氯化碳、氯仿、石油醚。熔点：57-61 °C沸点：296 °C
用途一:本品具有止咳、祛痰、平喘、解痉、镇静、抗癫痫、降血脂、利脂等作用，对肺炎双球菌、金黄色葡萄球菌和大肠杆菌的生长有不同程度的抑制作用，并具有一定的抗癌活性。临床用于治疗慢性支气管炎、支气管哮喘、成人肺炎、慢性阻塞性肺疾病伴肺部急性炎症、癫痫大发作及高脂血症等。