(2Z)-2-pentylidenecyclohexan-1-one

(2Z)-2-pentylidenecyclohexan-1-one 基本信息
CAS号 25677-40-1 分子式 C11H18O
分子量 166.26000 精确质量  166.13600
PSA  17.07000 LogP  3.24610

基本信息 展开↓

CAS号:
25677-40-1
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分子式:
C11H18O
分子量:
166.26000
英文名称:
(2Z)-2-pentylidenecyclohexan-1-one
英文别名:
(2Z)-2-pentylidenecyclohexan-1-one;
EINECS 247-178-8;
2-Pentylidenecyclohexanone;
Cyclohexanone,2-pentylidene;
2-Pentylidenecyclohexan-1-one;
(2Z)-2-pentylidene-cyclohexan-1-one
精确分子量/精确质量:
166.13600
极性分子表面积/PSA:
17.07000
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: KTETXLGRNPACFS-UHFFFAOYSA-N

物化性质展开↓

密度:
0.979g/cm3
沸点:
261.1ºC at 760mmHg
闪点:
108.5ºC
折射率:
1.532
蒸汽压:
0.0118mmHg at 25°C

合成路线查看所有的合成路线

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    三正丁基硼

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    2-(羟基亚甲基)环己酮

  • 25677-40-1

    (2Z)-2-pentylidenecyclohexan-1-one

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW1966000
CHEMICAL NAME :
Cyclohexanone, 2-pentylidene-
CAS REGISTRY NUMBER :
25677-40-1
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C11-H18-O
MOLECULAR WEIGHT :
166.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,797,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,797,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,797,1982

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