AG019NTY

Name: 1-Benzyl-3-(p-tolyl)-1H-pyrazole-4-carboxylic acid
Brand: Angene Chemical
SKU: AG019NTY

956453-12-6 | 1-Benzyl-3-(p-tolyl)-1H-pyrazole-4-carboxylic acid

AG019NTY

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CAS Number	956453-12-6
Catalog Number	AG019NTY
Chemical Name	1-Benzyl-3-(p-tolyl)-1H-pyrazole-4-carboxylic acid
IUPAC Name	1-benzyl-3-(4-methylphenyl)pyrazole-4-carboxylic acid
InChI	InChI=1S/C18H16N2O2/c1-13-7-9-15(10-8-13)17-16(18(21)22)12-20(19-17)11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,21,22)
InChI Key	LPXNEXTXAIVFDK-UHFFFAOYSA-N
MDL Number	MFCD06375940
Molecular Formula	C18H16N2O2
Molecular Weight	292.3318
SMILES	O=C(C1=CN(CC2=CC=CC=C2)N=C1C3=CC=C(C)C=C3)O
Synonyms	1-benzyl-3-(4-methylphenyl)-1H-pyrazole-4-carboxylic acid, 956453-12-6, 1-Benzyl-3-(p-tolyl)-1H-pyrazole-4-carboxylic acid, 1-benzyl-3-(4-methylphenyl)pyrazole-4-carboxylic Acid, AC1Q2K7L, MLS000760570, AC1M795N, CHEMBL1732531, CTK6B8200, HMS2766K16, ZINC3346470, AKOS027427197, MCULE-3623440109, NE22537, SMR000369838, EN300-11787, AB00663643-02, J-504271, Z57981098, CID2463142,

Complexity	373
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	292.121g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	292.338g/mol
Monoisotopic Mass	292.121g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited