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孔雀绿 | 10309-95-2

孔雀绿结构式图片|10309-95-2结构式图片
中文名称:孔雀绿
英文名称:Malachite green cation
CAS No.:10309-95-2 分子式:C23H25N2 分子量:329.457
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:孔雀绿结构式
孔雀绿的其他展现形式
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名称和标识符
Inchi InChI=1S/C23H25N2/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4/h5-17H,1-4H3/q+1
InChIKey VFCNQNZNPKRXIT-UHFFFAOYSA-N
SMILES CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3
别名信息
- 中文别名 -
孔雀绿
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- 英文别名 -
Methanaminium,N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl- [4-[(4-Dimethylaminophenyl)-phenylmethylidene]-1-cyclohexa-2,5-dienylidene]-dimethylazanium chloride malachite green Malachite green cation Ammonium,[4-[p-(dimethylamino)-a-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl- (8CI) malachite green cation [4-[α-Phenyl-4-(dimethylamino)benzylidene]-2,5-cyclohexadiene-1-ylidene]dimethyliminium Dimethyl[4-[4-(dimethylamino)phenyl(phenyl)methylene]-2,5-cyclohexadiene-1-ylidene]aminium [4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium N-[4-[[4-(Dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methylmethanaminium
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物化性质
 计算特性
精确分子量 329.20195
氢键供体数量 0
氢键受体数量 1
重原子数量 25
可旋转化学键数量 3
 实验特性
PSA 6.25
化合物详情(旧版)

SMILES

CC(=O)[O-].CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)=C3C=CC(=[N+](C)C)C=C3


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