1-环己基氨基-2-丙醇
- 中文名称:
- 1-环己基氨基-2-丙醇
- 中文别名:
- 1-环己基氨基-2-丙醇
- 英文名称:
- 2-Propanol,1-(cyclohexylamino)-
- 英文别名:
- 1-(cyclohexylamino)propan-2-ol;
EINECS 203-069-7;
Cyclohexylamine,N-propoxylated;
2-Propanol,1-(cyclohexylamino);
1-Cyclohexylaminopropan-2-ol;
USAF DO-19;
1-(cyclohexylamino)-2-propanol
- CAS No.:
- 103-00-4
- 分 子 式:
-
C9H19NO
- 分 子 量:
- 157.29
- 精确分子量:
- 157.14700
- PSA:
- 32.26000
- EINECS:
- 203-069-7
- InChI:
- The Key: HFHPBMVMXFZJNO-UHFFFAOYSA-N3
- 安全术语:
- Poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx.
- 分子结构式:
-

- SDS:
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1-环己基氨基-2-丙醇 物化性质
- 密度:
- 0.95g/cm3
- 沸点:
- 275.4ºC at 760mmHg
- 闪点:
- 107.1ºC
- 折射率:
- 1.478
- 蒸汽压:
- 0.000641mmHg at 25°C
1-环己基氨基-2-丙醇 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UA9625000
- CHEMICAL NAME :
- 2-Propanol, 1-(cyclohexylamino)-
- CAS REGISTRY NUMBER :
- 103-00-4
- BEILSTEIN REFERENCE NO. :
- 2072298
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H19-N-O
- MOLECULAR WEIGHT :
- 157.29
- WISWESSER LINE NOTATION :
- L6TJ AM1YQ1
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 :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161)
Formerly U.S. Clearinghouse for Scientific & Technical Information.
Volume(issue)/page/year: AD277-689
1-环己基氨基-2-丙醇 海关数据
中国海关编码:2922199090
- 概述:
- 2922199090. 其他氨基醇及其醚,酯和它们的盐(但含一种以上含氧基的除外). 增值税率:17.0%. 退税率:13.0%. 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, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
- 摘要/Summary:
- 2922199090. other amino-alcohols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
1-环己基氨基-2-丙醇 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):1.4
2.氢键供体数量:2
3.氢键受体数量:2
4.可旋转化学键数量:3
5.互变异构体数量:无
6.拓扑分子极性表面积32.3
7.重原子数量:11
8.表面电荷:0
9.复杂度:99.7
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:1
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1