乙腈-d3 | 2206-26-0
中文名称:
乙腈-d3
英文名称:
Acetonitrile-d3, 99.8%
CAS No.:
2206-26-0
分子式:
C2 H3 N
分子量:
44.0704
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:乙腈-d3结构式
简介
乙腈-d3是一种化学物质,分子式是C2D3N。
名称和标识符
MDL
MFCD00001881
InChIKey
WEVYAHXRMPXWCK-FIBGUPNXSA-N
Inchi
1S/C2H3N/c1-2-3/h1H3/i1D3
SMILES
N#CC([2H])([2H])[2H]
别名信息
- 中文别名 -
乙腈-d3
氘代乙氰
氘代乙腈
[ 2H3 ] - 乙腈标准品
氘代乙腈(氘代试剂)
氘代乙腈-D3
三氘代乙腈
ml,在N,N-二甲基甲酰胺
乙腈-D3,100μg
- 英文别名 -
Acetonitrile-d3
Acetonitriledisotopicpurity
PMI Labeled Standard Direct Injection
CD3CN
deuterated acetonitrile
Methyl-d3 cyanide
Methyl-d3 cyanide,Trideuteroacetonitrile
Trideuteroacetonitrile
Perdeuterioacetonitrile
Perdeuteroacetonitrile
Trideuterioacetonitrile
(2H3)Acetonitrile
2,2,2-trideuterioacetonitrile
Acetonitrile-d3-
Acetonitrile-2,2,2-d3
Acetonitrile D3 >99.8%
U787
Acetonitrile-d3,
Acetonitrile-d3, 99.8%
Acetonitrile D3
物化性质
实验特性
LogP
0.52988
PSA
23.79000
Merck
14,70
折射率
n20/D 1.341(lit.)
水溶性
Miscible with water, ethanol, diethyl ether, acetone, benzene, methanol, methyl acetate, ethyl acetate, acetamide solutions, chloroform, carbon tetrachloride, ethylene chloride and unsaturated hydrocarbons. Immiscible with saturated hydrocarbons.
沸点
80.7 °C(lit.)
熔点
-46 °C (lit.)
闪点
华氏:35.6 °F 摄氏:2 °C
颜色与性状
无色透明液体。有似乙醚气味。
稳定性
Stable. Flammable. Incompatible with strong oxidizing agents, strong acids.
溶解性
能与水、乙醇、醋酸甲酯、丙酮、乙醚、氯仿、四氯化碳混溶。
敏感性
Hygroscopic
密度
0.844 g/mL at 25 °C(lit.)
计算特性
精确分子量
44.04540
氢键供体数量
0
氢键受体数量
1
可旋转化学键数量
0
同位素质量
44.045
重原子数量
3
复杂度
29.3
同位素原子数量
3
确定原子立构中心数量
0
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
0
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
23.8
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