Cas no 64617-64-7 (4,5-diamino-2-chloroBenzoic acid methyl ester)

4,5-diamino-2-chloroBenzoic acid methyl ester structure
64617-64-7 structure
Product Name:4,5-diamino-2-chloroBenzoic acid methyl ester
CAS No:64617-64-7
MF:C8H9ClN2O2
MW:200.622260808945
CID:2130150
PubChem ID:20189756
Update Time:2025-04-21

4,5-diamino-2-chloroBenzoic acid methyl ester Chemical and Physical Properties

Names and Identifiers

    • 4,5-diamino-2-chloroBenzoic acid methyl ester
    • DB-357654
    • Benzoic acid, 4,5-diamino-2-chloro-, methyl ester
    • 64617-64-7
    • methyl4,5-diamino-2-chlorobenzoate
    • methyl 4,5-diamino-2-chlorobenzoate
    • SCHEMBL9793695
    • BS-32667
    • Inchi: 1S/C8H9ClN2O2/c1-13-8(12)4-2-6(10)7(11)3-5(4)9/h2-3H,10-11H2,1H3
    • InChI Key: YZANWUCFEFJRMT-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=C(C=C1C(=O)OC)N)N

Computed Properties

  • Exact Mass: 200.0352552Da
  • Monoisotopic Mass: 200.0352552Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 201
  • 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: 1
  • Topological Polar Surface Area: 78.3?2

4,5-diamino-2-chloroBenzoic acid methyl ester Pricemore >>

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