2-(azepan-1-yl)-1-(3,4-dihydroxyphenyl)ethanone

名称

[ CAS 号 ]:
20195-20-4

[ 英文名 ]:
2-(azepan-1-yl)-1-(3,4-dihydroxyphenyl)ethanone

物理化学性质

[ 密度 ]:
1.192g/cm3

[ 沸点 ]:
460.8ºC at 760 mmHg

[ 分子式 ]:
C₁₄H₁₉NO₃

[ 分子量 ]:
249.30600

[ 闪点 ]:
232.5ºC

[ 精确质量 ]:
249.13600

[ PSA ]:
60.77000

[ LogP ]:
2.09440

[ 蒸汽压 ]:
4.1E-09mmHg at 25°C

[ 折射率 ]:
1.576

毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AM7700500

CHEMICAL NAME :: Acetophenone, 3',4'-dihydroxy-2-(hexahydro-1H-azepin-1-yl)-

CAS REGISTRY NUMBER :: 20195-20-4

BEILSTEIN REFERENCE NO. :: 0201053

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H19-N-O3

MOLECULAR WEIGHT :: 249.34

WISWESSER LINE NOTATION :: T7NTJ A1VR CQ DQ

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 :: 43 mg/kg

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

REFERENCE :: AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. (Berlin, Ger.) V.110-253, 1925-66. For publisher information, see NSAPCC. Volume(issue)/page/year: 226,493,1955

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%