AG005PCC

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CAS Number	77169-11-0
Catalog Number	AG005PCC(AGN-PC-0LOUX8)
Chemical Name	3-Methyl-1-phenyl-1H-pyrazole-4-carboxylic acid
IUPAC Name	3-methyl-1-phenylpyrazole-4-carboxylic acid
InChI	InChI=1S/C11H10N2O2/c1-8-10(11(14)15)7-13(12-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15)
InChI Key	XSSINBQIDAICII-UHFFFAOYSA-N
MDL Number	MFCD01415214
Molecular Formula	C11H10N2O2
Molecular Weight	202.2093
SMILES	O=C(C1=CN(C2=CC=CC=C2)N=C1C)O
Synonyms	3-methyl-1-phenyl-1H-pyrazole-4-carboxylic acid, 77169-11-0, 1H-Pyrazole-4-carboxylicacid, 3-methyl-1-phenyl-, AC1NQWX3, AC1Q2PO6, SCHEMBL4298023, CTK2H5727, DTXSID60411719, XSSINBQIDAICII-UHFFFAOYSA-N, ZINC5533069, 5360AH, MFCD01415214, AKOS009112430, MCULE-5418853421, BS-14028, 1-Phenyl-3-methylpyrazole-4-carboxylic acid, 3-methyl-1-phenylpyrazole-4-carboxylic acid, CS-0058334, EN300-65276, A-8146, F2169-0609, Z228581550, 3-Methyl-1-phenyl-1H-pyrazole-4-carboxylic acid, AldrichCPR, C11H10N2O2, CID5230056, 3-methyl-1-phenyl-pyrazole-4-carboxylic Acid,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	202.213g/mol
Monoisotopic Mass	202.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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