2-(3-Cyano-3-(3,4-dichlorophenyl)propyl)oxytetrahydropyran

HCID 15670807

基本情報

標準SMILES
N#CC(CCOC1CCCCO1)c1ccc(Cl)c(Cl)c1
InChIKey
QKSKKRXPQXKKIJ-UHFFFAOYSA-N
分子式
C15H17Cl2NO2
平均分子量
314.2 g/mol

名称と識別子

優先名称
2-(3-Cyano-3-(3,4-dichlorophenyl)propyl)oxytetrahydropyran
IUPAC
2-(3,4-dichlorophenyl)-4-(oxan-2-yloxy)butanenitrile

名称と別名

2-(3-cyano-3-(3,4-dichlorophenyl)propyl)oxytetrahydropyran2-(3-cyano-3-[3,4-dichlorophenyl]propyl)oxytetrahydropyranSCHEMBL4630703QKSKKRXPQXKKIJ-UHFFFAOYSA-N2-(3,4-dichloro-phenyl)-4-(tetrahydro-pyran-2yloxy)-butyronitrile2-(3,4-dichloro-phenyl)-4-(tetrahydropyran-2-yl-oxy)-butyronitrile2-(3,4-Dichlorophenyl)-4-(tetrahydro-2-pyranyloxy)butanenitrile2-(3,4-dichlorophenyl)-4-(tetrahydropyran-2-yl-oxy)butanenitrile2-(3,4-Dichlorophenyl)-4-(tetrahydropyran-2-yloxy)-butanenitrile2-(3,4-Dichlorophenyl)-4-(tetrahydropyran-2-yloxy)butanenitrile3,4-Dichloro-alpha-(2-tetrahydropyranyloxyethyl)benzeneacetonitrile3,4-dichloro-alpha-(2tetrahydropyranyloxyethyl)benzeneacetonitrile
名称をさらに表示
alpha-(2-Tetrahydropyranyloxyethyl)-3,4-dichlorobenzeneacetonitrile3,4-dichloro-alpha-[(2-tetrahydropyranyloxy)ethyl]benzeneacetonitrilealpha-[2-(Tetrahydropyran-2-yloxy)ethyI]-3,4-dichlorophenylacetonitrile

データベース識別子

PubChem CID
15670807
Nikkaji
J2.017.684I

物性

構造計算による物性

XLogP
3.9
極性表面積
42.3 Ų
水素結合供与体数
0
水素結合受容体数
3
回転可能結合数
5
重原子数
20

関連反応

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