Chem
J-GLOBAL ID：200907001676718890   Nikkaji number：J542.892K

1-Chloro-3-(phenylthio)-2-propanone

1-クロロ-3-(フェニルチオ)-2-プロパノン
Substance type：
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
Molecular formula： C9H9ClOS
Molecular formula furigana： C9-H9-CL-O-S
Molecular weight： 200.680
InChI： InChI=1S/C9H9ClOS/c10-6-8(11)7-12-9-4-2-1-3-5-9/h1-5H,6-7H2
InChI key： KSEHRXGFMHHHSF-UHFFFAOYSA-N
SMILES： ClCC(=O)CSc1ccccc1
Systematic name  (3)：
  • 1-クロロ-3-(フェニルチオ)-2-プロパノン
  • 1-クロロ-3-(フェニルスルファニル)プロパン-2-オン
  • 1-chloro-3-(phenylsulfanyl)propan-2-one
Other name (1)：
  • 1-Chloro-3-(phenylthio)-2-propanone
CAS registry number： 22198-54-5
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