Cas no 691362-87-5 (7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid)

7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid structure
691362-87-5 structure
Product Name:7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid
CAS No:691362-87-5
MF:C12H10ClNO4
MW:267.665102481842
CID:1094566
PubChem ID:73554546
Update Time:2025-04-20

7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid
    • 7-chloro-2-methoxycarbonyl-3-methyl-1H-indole-4-carboxylic acid
    • 7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylicacid
    • 691362-87-5
    • Inchi: 1S/C12H10ClNO4/c1-5-8-6(11(15)16)3-4-7(13)10(8)14-9(5)12(17)18-2/h3-4,14H,1-2H3,(H,15,16)
    • InChI Key: OGKKKFNCQVYDQS-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C(=O)O)C2=C1NC(C(=O)OC)=C2C

Computed Properties

  • Exact Mass: 267.0298355g/mol
  • Monoisotopic Mass: 267.0298355g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 362
  • 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: 2.8
  • Topological Polar Surface Area: 79.4?2

7-Chloro-2-(methoxycarbonyl)-3-methyl-1H-indole-4-carboxylic acid Pricemore >>

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