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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1-benzyl-3-phenylpyrazole-4-carboxylic acid

OC(=O)c1cn(nc1c1ccccc1)Cc1ccccc1 Request for Quotation
Chemical Name: 1-benzyl-3-phenylpyrazole-4-carboxylic acid
CAS Number: 905589-98-2
Product Number: AG00IG75(AGN-PC-0KI5CT)
Synonyms:
MDL No: MFCD06364990
Molecular Formula: C17H14N2O2
Molecular Weight: 278.3053

Identification/Properties

Computed Properties
Molecular Weight:
278.311g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
278.106g/mol
Monoisotopic Mass:
278.106g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
349
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-Benzyl-3-phenyl-1H-pyrazole-4-carboxylic acid, a versatile compound, plays a crucial role in chemical synthesis due to its unique structural properties. This compound serves as a key intermediate in the preparation of various pharmaceuticals, agrochemicals, and other organic compounds. Its functional groups enable it to participate in a wide range of chemical reactions, making it a valuable building block in organic synthesis. Additionally, its pyrazole ring imparts bioactivity to the molecules it is incorporated into, enhancing the pharmacological properties of resulting compounds. Whether utilized in medicinal chemistry for drug discovery or in material science for the creation of novel materials, 1-Benzyl-3-phenyl-1H-pyrazole-4-carboxylic acid is an indispensable tool in the hands of synthetic chemists.