(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

2883-98-9
SMILES: C/C=C/c1cc(OC)c(OC)cc1OC

化学属性

Mol. FormulaC12H16O3
Mol. Weight208.25
Boiling Point296°C
Melting Point57-61°C
Density1.028

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 Number2883-98-9
PubChem Substance ID636822
EC Number220-743-6
Beilstein Registry Number1910606
MDL NumberMFCD00064457
Chemical Name Translation(E)-1,2,4-三甲氧基-5-(丙-1-烯-1-基)苯
Reaxys-RN1910606
Wiswesser Line Notation2U1R BO1 DO1 EO1 -T
LabNetwork Molecule IDLN00194907
InChIInChI=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 SMILESC/C=C/C1=C(OC)C=C(OC)C(OC)=C1
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分类

  • A, AR to AZ, Alcohols, Alphabetic, Analytical Standards, Analytical/Chromatography, Aromatic, Aromatics, Chemical Class, Natural Compounds, Natural Terpene Standards, Polyhydroxy compounds
  • {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
  • {SNA} Additional Standards, Alcohols, Analytical Standards, Aromatic, Aromatics, Chemical Class, Natural Compounds, Natural Terpene Standards, Polyhydroxy compounds, 分析/色谱
  • {SNA} A,

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。

相关文献及参考

  • Beilstein: 6,IV,7476

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 -20°C 2-8°C
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。

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkenes 烯烃
  5. Acyclic - Alkenes
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Natural Compounds - Chemical Class
  5. Natural Terpene Standards - Natural Compounds
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. A - Alphabetic
  5. AR to AZ - A

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