3-烯丙氧基丙腈

3-烯丙氧基丙腈 基本信息
CAS号 3088-44-6 分子式 C6H9NO
分子量 111.14200 精确质量  111.06800
PSA  33.02000 LogP  1.10268

基本信息 展开↓

CAS号:
3088-44-6
3D弹球模型:
立即前往扯扯看
分子式:
C6H9NO
分子量:
111.14200
中文名称:
3-烯丙氧基丙腈
英文名称:
3-prop-2-enoxypropanenitrile
中文别名:
3-烯丙氧基丙腈
英文别名:
3-prop-2-enoxypropanenitrile;
Propionitrile,3-allyloxy;
2-Cyanoethyl allyl ether;
3-Allyloxypropionitrile;
3-(2-propenoxy)propionitrile;
Allyl 2-cyanoethyl ether;
Propanenitrile,3-(2-propenyloxy);
3-(Allyloxy)propionitril;
3-Allyloxypropannitril [Czech]
精确分子量/精确质量:
111.06800
极性分子表面积/PSA:
33.02000
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: IXXSWIVBWMKRHZ-UHFFFAOYSA-N

物化性质展开↓

密度:
0.907g/cm3
沸点:
204.4ºC at 760mmHg
闪点:
82.9ºC
折射率:
1.423
存储条件/存储方法:
库房通风低温干燥,与食品原料分开存放

安全信息展开↓

海关代码:
2926909090
危险类别码:
36/37/38

合成路线查看所有的合成路线

  • 107-18-6

    烯丙醇

  • +

  • 107-13-1

    丙烯腈

  • ~90%

  • 3088-44-6

    3-烯丙氧基丙腈

  • 20907-32-8

    sodium allyloxide

  • +

  • 107-13-1

    丙烯腈

  • 3088-44-6

    3-烯丙氧基丙腈

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UG0175000
CHEMICAL NAME :
Propionitrile, 3-allyloxy-
CAS REGISTRY NUMBER :
3088-44-6
BEILSTEIN REFERENCE NO. :
1744073
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C6-H9-N-O
MOLECULAR WEIGHT :
111.16
WISWESSER LINE NOTATION :
NC2O2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,917,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,917,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1300 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,380,1952

海关数据查看详细

中国海关编码:2926909090

概述:
2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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