Chem
J-GLOBAL ID：200907032962739937
Nikkaji number：J1.157.728H
(S)-1-(2-Bromophenoxy)-2-hexanol
(S)-1-(2-ブロモフェノキシ)-2-ヘキサノール
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： C12H17BrO2
Molecular formula furigana： C12-H17-BR-O2
Molecular weight： 273.170
InChI：
InChI=1S/C12H17BrO2/c1-2-3-6-10(14)9-15-12-8-5-4-7-11(12)13/h4-5,7-8,10,14H,2-3,6,9H2,1H3/t10-/m0/s1
InChI key：
XRYVVRILUOEANQ-JTQLQIEISA-N
SMILES：
CCCC[C@H](O)COc1ccccc1Br
Systematic name (3)：
- (S)-1-(2-ブロモフェノキシ)-2-ヘキサノール
- (2S)-1-(2-ブロモフェノキシ)ヘキサン-2-オール
- (2S)-1-(2-bromophenoxy)hexan-2-ol
- (S)-1-(2-Bromophenoxy)-2-hexanol
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