Chem
J-GLOBAL ID：200907088716058241   Nikkaji number：J76.666F

4-Nitrobenzenepropanoic acid

4-ニトロベンゼンプロパン酸
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： C9H9[N+]O3[O-]
Molecular formula furigana： C9-H9-N-O4
Molecular weight： 195.174
InChI： InChI=1S/C9H9NO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5H,3,6H2,(H,11,12)
InChI key： VZOPVJNBOQOLPN-UHFFFAOYSA-N
SMILES： OC(=O)CCc1ccc(cc1)[N+](=O)[O-]
Systematic name  (5)：
  • 3-(4-ニトロフェニル)プロピオン酸
  • 4-ニトロベンゼンプロパン酸
  • 4-ニトロベンゼンプロピオン酸
  • 3-(4-ニトロフェニル)プロパン酸
  • 3-(4-nitrophenyl)propanoic acid
Other name (4)：
  • 4-Nitrobenzenepropanoic acid
  • 3-(4-Nitrophenyl)propionic acid
  • 4-Nitrobenzenepropionic acid
  • 3-(4-Nitrophenyl)propanoic acid
CAS registry number： 16642-79-8
Regulation number (1)：
  • (3)-3089
Thsaurus map：
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