ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate

ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate 基本信息
CAS号 13909-05-2 分子式 C11H18ClN3O4
分子量 291.73100 精确质量  291.09900
PSA  88.07000 LogP  2.18500

基本信息 展开↓

CAS号:
13909-05-2
3D弹球模型:
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分子式:
C11H18ClN3O4
分子量:
291.73100
英文名称:
ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate
英文别名:
ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate;
1-({[(2-chloroethyl)nitrosoamino]carbonyl}amino)-cyclopentanecarboxylic acid,ethyl ester;
Cyclopentanecarboxylic acid,1-(3-(2-chloroethyl)-3-nitrosoureido)-,ethyl ester;
1-(3-(2-Chloroethyl)-3-nitrosoureido)cyclopentanecarboxylic acid ethyl ester;
Cyclopentanecarboxylic acid,1-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-,ethyl ester;
ethyl 1-{[(2-chloroethyl)(nitroso)carbamoyl]amino}cyclopentanecarboxylate
精确分子量/精确质量:
291.09900
极性分子表面积/PSA:
88.07000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: DQKFATBSGXKDEH-UHFFFAOYSA-N

物化性质展开↓

密度:
1.36g/cm3
折射率:
1.565

合成路线查看所有的合成路线

  • 13908-10-6

    ethyl 1-(2-chloroethylcarbamoylamino)cyclopentane-1-carboxylate

  • 13909-05-2

    ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate

  • 1664-35-3

    1-氨基环戊烷-1-羧酸乙酯

  • 13909-05-2

    ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclopentane-1-carboxylate

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GY2628000
CHEMICAL NAME :
Cyclopentanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester
CAS REGISTRY NUMBER :
13909-05-2
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H18-Cl-N3-O4
MOLECULAR WEIGHT :
291.77
WISWESSER LINE NOTATION :
L5TJ AVO2 AMVNNO&2G

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 :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986

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  • 1664-35-3

    1-氨基环戊烷-1-羧酸乙酯

  • 13908-10-6

    ethyl 1-(2-chloroethylcarbamoylamino)cyclopentane-1-carboxylate

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