Cas no 58386-33-7 (1-phenyl-1H-indole-2-carboxylic acid)

1-Phenyl-1H-indole-2-carboxylic acid is a heterocyclic organic compound featuring an indole core substituted with a phenyl group at the 1-position and a carboxylic acid moiety at the 2-position. This structure imparts versatility in synthetic applications, particularly as a building block for pharmaceuticals, agrochemicals, and functional materials. The carboxylic acid group enables further derivatization through amidation, esterification, or metal-catalyzed coupling reactions, while the indole scaffold offers potential biological activity. Its well-defined crystalline form ensures consistent purity, making it suitable for research and industrial use. The compound's stability under standard conditions and compatibility with common organic solvents enhance its utility in multistep synthetic routes.
1-phenyl-1H-indole-2-carboxylic acid structure
58386-33-7 structure
Product Name:1-phenyl-1H-indole-2-carboxylic acid
CAS No:58386-33-7
MF:C15H11NO2
MW:237.253343820572
MDL:MFCD00602897
CID:342256
PubChem ID:646116
Update Time:2025-06-07

1-phenyl-1H-indole-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole-2-carboxylic acid, 1-phenyl-
    • 1-PHENYL-1H-INDOLE-2-CARBOXYLIC ACID
    • 1-Phenyl-indol-2-carbonsaeure
    • 1-phenyl-indole-2-carboxylic acid
    • AC1LDCYB
    • acido 1-fenilindolo-2-carbossilico
    • F1901-0148
    • l-phenylindole-2-carboxylic acid
    • N-phenylindole-2-carboxylic acid
    • Oprea1_131946
    • Oprea1_758371
    • SureCN5208338
    • 1-phenylindol-2-carboxylic acid
    • EU-0003872
    • CHEMBL1587360
    • SMR000000985
    • AB00407376-04
    • 1-phenylindole-2-carboxylic acid
    • HMS2316C09
    • WMHIWHPGXRRKJM-UHFFFAOYSA-N
    • 1-Phenyl-1H-indole-2-carboxylicacid
    • 8-Dibromochrysene
    • HMS1604K08
    • DTXSID70349418
    • AKOS000267872
    • EN300-235940
    • 58386-33-7
    • MLS000031299
    • SCHEMBL5208338
    • DB-312300
    • STK074913
    • 1-phenyl-1H-indole-2-carboxylic acid
    • MDL: MFCD00602897
    • Inchi: 1S/C15H11NO2/c17-15(18)14-10-11-6-4-5-9-13(11)16(14)12-7-2-1-3-8-12/h1-10H,(H,17,18)
    • InChI Key: WMHIWHPGXRRKJM-UHFFFAOYSA-N
    • SMILES: OC(C1=CC2C=CC=CC=2N1C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 237.07903
  • Monoisotopic Mass: 237.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 312
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.7
  • Topological Polar Surface Area: 42.2?2

Experimental Properties

  • PSA: 42.23

1-phenyl-1H-indole-2-carboxylic acid Pricemore >>

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