1,1,1,3,3-pentachloropropan-2-one

1,1,1,3,3-pentachloropropan-2-one 基本信息
CAS号 1768-31-6 分子式 C3HCl5O
分子量 230.30400 精确质量  227.84700
PSA  17.07000 LogP  2.72940

基本信息 展开↓

CAS号:
1768-31-6
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分子式:
C3HCl5O
分子量:
230.30400
英文名称:
1,1,1,3,3-pentachloropropan-2-one
英文别名:
1,1,1,3,3-pentachloropropan-2-one;
1,1,1,3,3-pentachloro-2-propanone;
2-Propanone,1,1,1,3,3-pentachloro;
EINECS 217-188-7;
Pentachloroacetone;
Pentachloropropanone;
pentachloropropan-2-one;
1,1,1,3,3-Pentachloropropanone;
1,1,1,3,3-Pentachlor-2-propanon;
1,1,1,3,3-Pentachloroacetone
精确分子量/精确质量:
227.84700
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。
EINECS:
217-188-7
InChI:
The Key: RVSIFWBAGVMQKT-UHFFFAOYSA-N

合成路线查看所有的合成路线

  • 116-16-5

    六氯丙酮

  • ~85%

  • 1768-31-6

    1,1,1,3,3-pentachloropropan-2-one

  • 87651-34-1

    trimethyl(1,1,3,3,3-pentachloroprop-1-en-2-yloxy)silane

  • ~72%

  • 75-77-4

    三甲基氯硅烷

  • +

  • 1768-31-6

    1,1,1,3,3-pentachloropropan-2-one

  • 87651-34-1

    trimethyl(1,1,3,3,3-pentachloroprop-1-en-2-yloxy)silane

  • ~69%

  • 1768-31-6

    1,1,1,3,3-pentachloropropan-2-one

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UC3300000
CHEMICAL NAME :
2-Propanone, 1,1,1,3,3-pentachloro-
CAS REGISTRY NUMBER :
1768-31-6
BEILSTEIN REFERENCE NO. :
1766425
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C3-H-Cl5-O
MOLECULAR WEIGHT :
230.29
WISWESSER LINE NOTATION :
FYFVXFFF

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 :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
450 mg/m3/2H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Gene conversion and mitotic recombination
TEST SYSTEM :
Yeast - Saccharomyces cerevisiae
DOSE/DURATION :
100 ug/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 155,53,1985 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7151 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 1822 (estimated) No. of Female Employees: 272 (estimated)

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上游产品

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  • 116-16-5

    六氯丙酮

  • 67-64-1

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