(2R,3R)-2-chloro-3-methyloxirane

(2R,3R)-2-chloro-3-methyloxirane 基本信息
CAS号 21947-76-2 分子式 C3H5ClO
分子量 92.52420 精确质量  92.00290
PSA  12.53000 LogP  0.97000

等价的CAS号:

21947-75-1,21947-76-2,66794-22-7

基本信息 展开↓

CAS号:
21947-76-2
3D弹球模型:
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分子式:
C3H5ClO
分子量:
92.52420
英文名称:
(2R,3R)-2-chloro-3-methyloxirane
英文别名:
(2R,3R)-2-chloro-3-methyloxirane;
Propane,1-chloro-1,2-epoxy-,(E);
trans-1-Chloro-1,2-epoxypropane;
trans-2-Chloro-3-methyloxirane;
trans-1-Chloropropene oxide;
trans-Cpo
精确分子量/精确质量:
92.00290
极性分子表面积/PSA:
12.53000
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: LRWZZZWJMFNZIK-GBXIJSLDSA-N

物化性质展开↓

蒸汽压:
61.1mmHg at 25°C

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TX4850000
CHEMICAL NAME :
Propane, 1-chloro-1,2-epoxy-, (E)-
CAS REGISTRY NUMBER :
21947-76-2
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C3-H5-Cl-O
MOLECULAR WEIGHT :
92.53
WISWESSER LINE NOTATION :
T3OTJ BG C1 -T

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg/73W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Skin and Appendages - tumors Tumorigenic - tumors at site of application
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
40 mg/kg/60W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Skin and Appendages - tumors Tumorigenic - tumors at site of application

MUTATION DATA

TYPE OF TEST :
Morphological transformation
TEST SYSTEM :
Rodent - hamster Embryo
DOSE/DURATION :
550 umol/L
REFERENCE :
JJIND8 JNCI, Journal of the National Cancer Institute. (Washington, DC) V.61-79, 1978-87. For publisher information, see JNCIEQ. Volume(issue)/page/year: 69,531,1982
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