1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid methyl ester

名称

[ CAS 号 ]:
31539-88-5

[ 英文名 ]:
1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid methyl ester

[英文别名 ]:

Dehydroquinuclidine-3-carboxylic acid
Methyl dehydroquinuclidine-3-carboxylate
3-methoxycarbonyl-2,3-didehydroquinuclidine

物理化学性质

[ 密度 ]:
1.16g/cm3

[ 沸点 ]:
250.5ºC at 760mmHg

[ 分子式 ]:
C₉H₁₃NO₂

[ 分子量 ]:
167.20500

[ 闪点 ]:
103.4ºC

[ 精确质量 ]:
167.09500

[ PSA ]:
29.54000

[ LogP ]:
0.70680

[ 折射率 ]:
1.538

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CL6176000

CHEMICAL NAME :: 1-Azabicyclo(2.2.2)oct-2-ene-3-carboxylic acid, methyl ester

CAS REGISTRY NUMBER :: 31539-88-5

BEILSTEIN REFERENCE NO. :: 0132895

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H13-N-O2

MOLECULAR WEIGHT :: 167.23

WISWESSER LINE NOTATION :: T66 A B CN AUTJ AVO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 19 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Gastrointestinal - changes in structure or function of salivary glands Kidney, Ureter, Bladder - urine volume increased

REFERENCE :: RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 35,55,1972

点击显示

安全信息

[ 海关编码 ]:
2933990090

合成路线

详细合成路线

海关

[ 海关编码 ]: 2933990090

[ 中文概述 ]:
2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

[ 申报要素 ]: 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%