2,3,3-trichloroprop-2-enal

2,3,3-trichloroprop-2-enal 基本信息
CAS号 3787-28-8 分子式 C3HCl3O
分子量 159.39800 精确质量  157.90900
PSA  17.07000 LogP  2.07080

基本信息 展开↓

CAS号:
3787-28-8
3D弹球模型:
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分子式:
C3HCl3O
分子量:
159.39800
英文名称:
2,3,3-trichloroprop-2-enal
英文别名:
2,3,3-trichloroprop-2-enal;
2,3,3-Trichloro-2-propenal;
Trichlor-acrylaldehyd;
2,3,3-Trichloropropenal;
Trichloracrolein;
trichloropropenal;
2,3,3-Trichloroacrolein;
trichloroacrolein;
ACROLEIN,2,3,3-TRICHLORO;
trichloro-acrylaldehyde;
2-Propenal,2,3,3-trichloro
精确分子量/精确质量:
157.90900
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: ZLWJEEVJKLGSRT-UHFFFAOYSA-N

物化性质展开↓

密度:
1.551g/cm3
沸点:
185.7ºC at 760mmHg
闪点:
71.1ºC
折射率:
1.504

安全信息展开↓

海关代码:
2913000090

合成路线查看所有的合成路线

  • 21400-41-9

    1,1,2,4,4-pentachlorobuta-1,3-diene

  • ~8%

  • 3787-28-8

    2,3,3-trichloroprop-2-enal

  • +

  • 61351-34-6

    1,1,2,4,4-pentachloro-3-nitrobuta-1,3-diene

  • 1561-37-1

    1561-37-1

  • 3787-28-8

    2,3,3-trichloroprop-2-enal

  • 53356-86-8

    1,1,2-trichloro-3,3-diethoxy-propene

  • 3787-28-8

    2,3,3-trichloroprop-2-enal

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AS2500000
CHEMICAL NAME :
Acrolein, 2,3,3-trichloro-
CAS REGISTRY NUMBER :
3787-28-8
BEILSTEIN REFERENCE NO. :
1745438
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C3-H-Cl3-O
MOLECULAR WEIGHT :
159.39
WISWESSER LINE NOTATION :
VHYGUYGG

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 :
4 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
120 ng/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 157,111,1985

海关数据查看详细

中国海关编码:2913000090

概述:
2913000090 品目2912所列产品的其他衍生物〔指卤化,磺化,硝化或亚硝化的衍生物〕. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

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