Chem
J-GLOBAL ID：200907035764940227
Nikkaji number：J1.913.389C
3α-(3-Chlorophenyl)oxirane-2β-carbonitrile
3α-(3-クロロフェニル)オキシラン-2β-カルボニトリル
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C9H6ClNO
Molecular formula furigana： C9-H6-CL-N-O
Molecular weight： 179.600
InChI：
InChI=1S/C9H6ClNO/c10-7-3-1-2-6(4-7)9-8(5-11)12-9/h1-4,8-9H/t8-,9-/m0/s1
InChI key：
MZLFTAZMPRBRNN-IUCAKERBSA-N
SMILES：
Clc1cccc(c1)[C@@H]1O[C@H]1C#N
Systematic name (3)：
- 3α-(3-クロロフェニル)オキシラン-2β-カルボニトリル
- (2S,3S)-3-(3-クロロフェニル)オキシラン-2-カルボニトリル
- (2S,3S)-3-(3-chlorophenyl)oxirane-2-carbonitrile
- 3α-(3-Chlorophenyl)oxirane-2β-carbonitrile
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