2,2,3-三氯丙腈

2,2,3-三氯丙腈 基本信息
CAS号 813-74-1 分子式 C3H2Cl3N
分子量 158.41400 精确质量  156.92500
PSA  23.79000 LogP  1.92268

基本信息 展开↓

CAS号:
813-74-1
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分子式:
C3H2Cl3N
分子量:
158.41400
中文名称:
2,2,3-三氯丙腈
英文名称:
2,2,3-TRICHLOROPROPIONITRILE
中文别名:
2,2,3-三氯丙腈
英文别名:
2,2,3-TRICHLOROPROPIONITRILE;
2,2,3-trichlorpropannitril;
2,2,3-Trichlor-propionitril;
2,2,3-trichloro-propionitrile;
alphaalphabeta-trichloropropionitrile;
2,2,3-trichloropropiononitrile;
A,A,B-TRICHLOROPROPIONITRILE;
2,2,3-trichloro-propionitril;
2,2,3-trichloro-propanenitril;
2,2,3-trichloropropanenitrile
精确分子量/精确质量:
156.92500
极性分子表面积/PSA:
23.79000
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: XMVOGXZDRUZXAP-UHFFFAOYSA-N

物化性质展开↓

密度:
1.499g/cm3
沸点:
186ºC at 760 mmHg
闪点:
70.2ºC
折射率:
1.486

合成路线查看所有的合成路线

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毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UG4820000
CHEMICAL NAME :
Propionitrile, 2,2,3-trichloro-
CAS REGISTRY NUMBER :
813-74-1
BEILSTEIN REFERENCE NO. :
1748667
LAST UPDATED :
199706
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C3-H2-Cl3-N
MOLECULAR WEIGHT :
158.41
WISWESSER LINE NOTATION :
NCXGG1G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,908,1986
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,908,1986
TYPE OF TEST :
LC - Lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>3 gm/m3/10M
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NDRC** National Defense Research Committee, Office of Scientific Research and Development, Progress Report. Volume(issue)/page/year: NDCrc-132,June,1942
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,908,1986

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