Cas no 60875-16-3 (1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone)

1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone is a versatile heterocyclic compound featuring a pyrazolone core substituted with a carboxyphenyl group. This structure imparts unique reactivity, making it valuable as an intermediate in organic synthesis, particularly for the preparation of dyes, pharmaceuticals, and coordination complexes. The carboxyl group enhances solubility in polar solvents and facilitates further functionalization, while the pyrazolone moiety contributes to chelating properties, useful in metal ion binding applications. Its well-defined crystalline form ensures consistent purity, critical for research and industrial processes. The compound’s stability under standard conditions and compatibility with diverse reaction conditions underscore its utility in fine chemical and material science applications.
1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone structure
60875-16-3 structure
Product Name:1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone
CAS No:60875-16-3
MF:C11H10N2O3
MW:218.20870256424
MDL:MFCD00003135
CID:57608
PubChem ID:109029
Update Time:2025-06-09

1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone Chemical and Physical Properties

Names and Identifiers

    • 4-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
    • 1-(4-CARBOXYPHENYL)-3-METHYL-2-PYRAZOLIN-5-ON
    • 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
    • 4-(3-Methyl-5-oxo-4,5-dihydro-pyrazol-1-yl)-benzoic acid
    • 4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzoic acid
    • 4-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoate
    • Maquindox
    • Benzoicacid, p-(3-methyl-5-oxo-2-pyrazolin-1-yl)- (6CI)
    • 1-(4-Carboxyphenyl)-3-methyl-2-pyrazolin-5-one
    • 1-(4-Carboxyphenyl)-3-methyl-2-pyrazolinone
    • 1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone
    • 1-(p-Carboxyphenyl)-3-methyl-5-pyrazolone
    • 4-(3-Methyl-5-oxopyrazol-1-yl)benzoicacid
    • Mequindox (4-dioxyquioxaline)
    • BP-12690
    • BB 0221237
    • CAS-60875-16-3
    • 60875-16-3
    • 4-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoicacid
    • HY-W014078
    • EN300-16242
    • CCG-237421
    • 4-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzoic acid
    • Oprea1_867127
    • EINECS 262-509-6
    • AS-45876
    • DTXCID6024963
    • AC-18394
    • 4-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid #
    • p-(3-Methyl-5-oxo-2-pyrazolin-1-yl)-benzoic acid
    • 4-(4,5-dihydro-5-oxo-3-methyl-1H-pyrazol-1-yl)-benzoic acid
    • Z50147717
    • A832935
    • 1-(4-Carboxylphenyl)-3-methyl-5-pyrazolone
    • HMS1542F05
    • TimTec1_002931
    • NS00034487
    • CK2185
    • 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid, >=98%
    • CHEMBL378534
    • SCHEMBL643536
    • CS-W014794
    • p-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoic acid
    • AKOS000112839
    • 4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-benzoic acid
    • UNII-I29T029IWB
    • FT-0605670
    • Benzoic acid, 4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-
    • W-105225
    • Tox21_301816
    • MFCD00003135
    • DTXSID8044963
    • Q27280282
    • 1-p-carboxyphenyl-3-methyl-2-pyrazolin-5-one
    • NCGC00256128-01
    • BBL001440
    • STK059563
    • 4-(3-Methyl-5-oxo-2-pyrazolin-1-yl)benzoicacid
    • DB-053728
    • ALBB-019196
    • MOPBA
    • MDL: MFCD00003135
    • Inchi: 1S/C11H10N2O3/c1-7-6-10(14)13(12-7)9-4-2-8(3-5-9)11(15)16/h2-5H,6H2,1H3,(H,15,16)
    • InChI Key: CUGBBQWDGCXWNB-UHFFFAOYSA-N
    • SMILES: O=C1CC(C)=NN1C1C=CC(C(=O)O)=CC=1

Computed Properties

  • Exact Mass: 218.06900
  • Monoisotopic Mass: 218.069142
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 343
  • 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
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 0.8
  • Topological Polar Surface Area: 70

Experimental Properties

  • Color/Form: Not available
  • Density: 1.2699 (rough estimate)
  • Melting Point: 285?°C (dec.) (lit.)
  • Boiling Point: 358.89°C (rough estimate)
  • Flash Point: 242.7±24.0 °C
  • Refractive Index: 1.5300 (estimate)
  • PSA: 69.97000
  • LogP: 0.99800
  • Solubility: Not available
  • Vapor Pressure: 0.0±1.3 mmHg at 25°C

1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone Security Information

1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone Customs Data

  • HS CODE:2933199090
  • Customs Data:

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. 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:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:60875-16-3)1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone
Order Number:A832935
Stock Status:in Stock
Quantity:500g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:30
Price ($):3934.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:60875-16-3)1-(4-Carboxyphenyl)-3-methyl-5-pyrazolone
A832935
Purity:99%
Quantity:500g
Price ($):3934.0
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