1,3,3-Triethoxy-1-propene

1,3,3-Triethoxy-1-propene 基本信息
CAS号 5444-80-4 分子式 C9H18O3
分子量 174.23700 精确质量  174.12600
PSA  27.69000 LogP  1.93570

基本信息 展开↓

CAS号:
5444-80-4
3D弹球模型:
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分子式:
C9H18O3
分子量:
174.23700
英文名称:
1,3,3-Triethoxy-1-propene
英文别名:
1,3,3-Triethoxy-1-propene;
3-ethoxy-acrylaldehyde diethylacetal;
3-ethoxy-propenal diethyl acetal;
1,3,3-triethoxy-propene;
1-Propene,1,3,3-triethoxy;
3-Aethoxy-acrylaldehyd-diaethylacetal
精确分子量/精确质量:
174.12600
极性分子表面积/PSA:
27.69000
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: ATAQLIDYIFWHFW-UHFFFAOYSA-N

物化性质展开↓

密度:
0.916g/cm3
沸点:
171.3ºC at 760mmHg
闪点:
53.6ºC
折射率:
1.428

安全信息展开↓

海关代码:
2909199090

合成路线查看所有的合成路线

  • 64-17-5

    乙醇

  • +

  • 6630-39-3

    2-bromo-1,1,3-triethoxypropane

  • 5444-80-4

    1,3,3-Triethoxy-1-propene

  • 105-57-7

    乙缩醛

  • +

  • 122-51-0

    原甲酸三乙酯

  • 5444-80-4

    1,3,3-Triethoxy-1-propene

  • 462-95-3

    二乙氧基甲烷

  • 5444-80-4

    1,3,3-Triethoxy-1-propene

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AS1750000
CHEMICAL NAME :
Acrolein, 3-ethoxy-, diethyl acetal
CAS REGISTRY NUMBER :
5444-80-4
LAST UPDATED :
199806
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H18-O3
MOLECULAR WEIGHT :
174.27
WISWESSER LINE NOTATION :
2OYO2&1U1O2

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 :
2460 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 4,119,1951
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 ppm/4H
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JIHTAB Journal of Industrial Hygiene and Toxicology. (Cambridge, MA) V.18-31, 1936-49. For publisher information, see AEHLAU. Volume(issue)/page/year: 31,343,1949
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
370 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 4,119,1951

海关数据查看详细

中国海关编码:2909199090

概述:
2909199090. 其他无环醚及其卤化衍生物(包括磺化,硝化或亚硝化衍生物). 增值税率:17.0%. 退税率:13.0%. 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:
2909199090. other acyclic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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