Chem
J-GLOBAL ID：200907013695487848   Nikkaji number：J1.746.266K

1-(2-Cyanoethyl)-3,4-dimethyl-1H-phosphole-2,5-dicarboxylic acid

1-(2-シアノエチル)-3,4-ジメチル-1H-ホスホール-2,5-ジカルボン酸
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： C11H12NO4P
Molecular formula furigana： C11-H12-N-O4-P
Molecular weight： 253.194
InChI： InChI=1S/C11H12NO4P/c1-6-7(2)9(11(15)16)17(5-3-4-12)8(6)10(13)14/h3,5H2,1-2H3,(H,13,14)(H,15,16)
InChI key： VMYVLGDORFWLAV-UHFFFAOYSA-N
SMILES： Cc1c(C)c(C(=O)O)p(CCC#N)c1C(=O)O
Systematic name  (2)：
  • 1-(2-シアノエチル)-3,4-ジメチル-1H-ホスホール-2,5-ジカルボン酸
  • 1-(2-cyanoethyl)-3,4-dimethyl-1H-phosphole-2,5-dicarboxylic acid
Other name (1)：
  • 1-(2-Cyanoethyl)-3,4-dimethyl-1H-phosphole-2,5-dicarboxylic acid
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