Chem
J-GLOBAL ID：200907044877987164   Nikkaji number：J1.360.272G

RS-136270

1-(3-クロロベンジル)-1H-ピロール-2-カルボン酸
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： C12H10ClNO2
Molecular formula furigana： C12-H10-CL-N-O2
Molecular weight： 235.670
InChI： InChI=1S/C12H10ClNO2/c13-10-4-1-3-9(7-10)8-14-6-2-5-11(14)12(15)16/h1-7H,8H2,(H,15,16)
InChI key： VPTUTBZAHHDMAA-UHFFFAOYSA-N
SMILES： OC(=O)c1cccn1Cc1cccc(Cl)c1
Systematic name  (3)：
  • 1-(3-クロロベンジル)-1H-ピロール-2-カルボン酸
  • 1-[(3-クロロフェニル)メチル]-1H-ピロール-2-カルボン酸
  • 1-[(3-chlorophenyl)methyl]-1H-pyrrole-2-carboxylic acid
Other name (2)：
  • 1-(3-Chlorobenzyl)-1H-pyrrole-2-carboxylic acid
  • RS-136270
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