Chem
J-GLOBAL ID：200907034072763426
Nikkaji number：J2.195.495K
4-Bromothiobenzoic acid S-(4-chlorophenyl) ester
4-ブロモチオ安息香酸S-(4-クロロフェニル)
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： C13H8BrClOS
Molecular formula furigana： C13-H8-BR-CL-O-S
Molecular weight： 327.620
InChI：
InChI=1S/C13H8BrClOS/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-8H
InChI key：
HYLQINPSMIVLGA-UHFFFAOYSA-N
SMILES：
Clc1ccc(SC(=O)c2ccc(Br)cc2)cc1
Systematic name (3)：
- 4-ブロモチオ安息香酸S-(4-クロロフェニル)
- (4-ブロモフェニル)[(4-クロロフェニル)スルファニル]メタノン
- (4-bromophenyl)[(4-chlorophenyl)sulfanyl]methanone
- 4-Bromothiobenzoic acid S-(4-chlorophenyl) ester
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