AG00HBX9

Name: 3-(1,2-Dihydro-2-oxo-5-pyrimidinyl)benzoic acid
Brand: Angene Chemical
SKU: AG00HBX9

1111108-95-2 | 3-(1,2-Dihydro-2-oxo-5-pyrimidinyl)benzoic acid

AG00HBX9

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CAS Number	1111108-95-2
Catalog Number	AG00HBX9(AGN-PC-0WR5B2)
Chemical Name	3-(1,2-Dihydro-2-oxo-5-pyrimidinyl)benzoic acid
IUPAC Name	3-(2-oxo-1H-pyrimidin-5-yl)benzoic acid
InChI	InChI=1S/C11H8N2O3/c14-10(15)8-3-1-2-7(4-8)9-5-12-11(16)13-6-9/h1-6H,(H,14,15)(H,12,13,16)
InChI Key	OQBIJKSTMQOQND-UHFFFAOYSA-N
MDL Number	MFCD11876892
Molecular Formula	C11H8N2O3
Molecular Weight	216.1928
SMILES	O=C(O)C1=CC=CC(=C1)C=2C=NC(=O)NC2
Synonyms	1111108-95-2, 5-(3-CARBOXYPHENYL)-2-HYDROXYPYRIMIDINE, 3-(2-Hydroxypyrimidin-5-yl)benzoic acid, 3-(2-Oxo-1,2-dihydropyrimidin-5-yl)benzoic acid, DTXSID70686815, MFCD11876892, ZINC65344624, AKOS023564161,

Complexity	373
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.053g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	216.196g/mol
Monoisotopic Mass	216.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	78.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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