Chem
J-GLOBAL ID：200907055462390326
Nikkaji number：J1.902.486E
2-(4-Chlorophenylthio)butanoic acid ethyl ester
2-(4-クロロフェニルチオ)ブタン酸エチル
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： C12H15ClO2S
Molecular formula furigana： C12-H15-CL-O2-S
Molecular weight： 258.760
InChI：
InChI=1S/C12H15ClO2S/c1-3-11(12(14)15-4-2)16-10-7-5-9(13)6-8-10/h5-8,11H,3-4H2,1-2H3
InChI key：
USHRCMKQTAJQSL-UHFFFAOYSA-N
SMILES：
CCOC(=O)C(CC)Sc1ccc(Cl)cc1
Systematic name (4)：
- 2-(4-クロロフェニルチオ)ブタン酸エチル
- 2-[(4-クロロフェニル)チオ]ブタン酸エチル
- エチル 2-[(4-クロロフェニル)スルファニル]ブタノアート
- ethyl 2-[(4-chlorophenyl)sulfanyl]butanoate
- 2-(4-Chlorophenylthio)butanoic acid ethyl ester
- 2-[(4-Chlorophenyl)thio]butanoic acid ethyl ester
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