3,4,6,7-Tetrahydropyrrolo(3,2,1-jk)(1,4)benzodiazepin-1(2H)-one

名称

[ CAS 号 ]:
28740-77-4

[ 英文名 ]:
3,4,6,7-Tetrahydropyrrolo(3,2,1-jk)(1,4)benzodiazepin-1(2H)-one

物理化学性质

[ 密度 ]:
1.29g/cm3

[ 沸点 ]:
479.7ºC at 760mmHg

[ 分子式 ]:
C₁₁H₁₂N₂O

[ 分子量 ]:
188.22600

[ 闪点 ]:
243.9ºC

[ 精确质量 ]:
188.09500

[ PSA ]:
35.83000

[ LogP ]:
0.86790

[ 蒸汽压 ]:
2.31E-09mmHg at 25°C

[ 折射率 ]:
1.657

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UY8540000

CHEMICAL NAME :: Pyrrolo(3,2,1-jk)(1,4)benzodiazepin-1(2H)-one, 3,4,6,7-tetrahydro-

CAS REGISTRY NUMBER :: 28740-77-4

BEILSTEIN REFERENCE NO. :: 0011613

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H12-N2-O

MOLECULAR WEIGHT :: 188.25

WISWESSER LINE NOTATION :: T567 1A M BN JVMT&TJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 562 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

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: 13,827,1970

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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%