甲酸-D2 | 920-42-3
中文名称:
甲酸-D2
英文名称:
Formic Acid-d2 (95% w/w in D2O)
CAS No.:
920-42-3
分子式:
CH2 O2
分子量:
48.0377039909363
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:甲酸-D2结构式
名称和标识符
MDL
MFCD00037363
InChIKey
BDAGIHXWWSANSR-PFUFQJKNSA-N
Inchi
1S/CH2O2/c2-1-3/h1H,(H,2,3)/i1D/hD
SMILES
C([2H])(=O)O[2H]
别名信息
- 英文别名 -
Formic-d acid-d
Formic acid-d2
deuterio deuterioformate
Perdeuterioformic acid
物化性质
实验特性
LogP
0.33670
PSA
37.30000
折射率
n20/D 1.369(lit.)
沸点
100.8 °C(lit.)
熔点
8.2-8.4 °C (lit.)
闪点
华氏:123.8 °F 摄氏:51 °C
浓度
95 wt. % in D2O
颜色与性状
无色透明液体
溶解性
溶于水
密度
1.273 g/mL at 25 °C
计算特性
精确分子量
48.01800
氢键供体数量
1
氢键受体数量
2
可旋转化学键数量
0
重原子数量
3
复杂度
10.3
同位素原子数量
2
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)
-0.2
互变异构体数量
无
表面电荷
0
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