Cas no 62972-61-6 (1H-1,2,3-benzotriazole-4-carboxylic acid)

1H-1,2,3-benzotriazole-4-carboxylic acid structure
62972-61-6 structure
Product Name:1H-1,2,3-benzotriazole-4-carboxylic acid
CAS No:62972-61-6
MF:C7H5N3O2
MW:163.133500814438
MDL:MFCD18088581
CID:958425
PubChem ID:6454490
Update Time:2025-04-19

1H-1,2,3-benzotriazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1H-benzotriazole-7-carboxylic acid
    • 2H-benzotriazole-4-carboxylic acid
    • BENZOTRIAZOLE-4-CARBOXYLIC ACID
    • 1H-Benzotriazol-4-carbonsaeure
    • 1H-Benzotriazole-4-carboxylic acid
    • 4-carboxy-1H-benzotriazole
    • 4-carboxybenzotriazole
    • Benzotriazole-7-cooh
    • benzotriazolecarboxylic acid
    • Carboxybenzotriazole
    • 1H-1,2,3-benzotriazole-4-carboxylic acid
    • 3H-benzo[d][1,2,3]triazole-4-carboxylic acid
    • 1H-Benzo[d][1,2,3]triazole-7-carboxylic acid
    • SCHEMBL535394
    • MFCD18088581
    • Q63409265
    • AKOS006271458
    • DB-082457
    • SCHEMBL170674
    • DTXSID10212177
    • 2h-benzotriazole-4-carboxylic
    • NS00014524
    • 1H-Benzotriazole-4-carboxylic acid (Tentative)
    • EN300-108423
    • AKOS005152024
    • Z1625822259
    • BS-38359
    • E86042
    • 62972-61-6
    • CS-0139407
    • 1H-Benzo[d][1,2,3]triazole-4-carboxylic acid
    • 1H-Benzo[d][1,2,3]triazole-4-carboxylicacid
    • 1H-1,2,3-benzotriazole-7-carboxylic acid
    • MDL: MFCD18088581
    • Inchi: 1S/C7H5N3O2/c11-7(12)4-2-1-3-5-6(4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)
    • InChI Key: KFJDQPJLANOOOB-UHFFFAOYSA-N
    • SMILES: OC(C1=CC=CC2C1=NNN=2)=O

Computed Properties

  • Exact Mass: 163.03800
  • Monoisotopic Mass: 163.038176
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 197
  • 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
  • Topological Polar Surface Area: 78.9
  • XLogP3: 0.5

Experimental Properties

  • Density: 1.617
  • Boiling Point: 455.9 °C at 760 mmHg
  • Flash Point: 229.5 °C
  • PSA: 78.87000
  • LogP: 0.65610

1H-1,2,3-benzotriazole-4-carboxylic acid Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1H-1,2,3-benzotriazole-4-carboxylic acid Pricemore >>

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