AG003WNK

Name: 5-(4-Methylsulfonylphenyl)nicotinic Acid
Brand: Angene Chemical
SKU: AG003WNK

893740-53-9 | 5-(4-Methylsulfonylphenyl)nicotinic Acid

AG003WNK

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CAS Number	893740-53-9
Catalog Number	AG003WNK(AGN-PC-0WAASQ)
Chemical Name	5-(4-Methylsulfonylphenyl)nicotinic Acid
IUPAC Name	5-(4-methylsulfonylphenyl)pyridine-3-carboxylic acid
InChI	InChI=1S/C13H11NO4S/c1-19(17,18)12-4-2-9(3-5-12)10-6-11(13(15)16)8-14-7-10/h2-8H,1H3,(H,15,16)
InChI Key	YOCRSNWIZIKZCZ-UHFFFAOYSA-N
MDL Number	MFCD06802759
Molecular Formula	C13H11NO4S
Molecular Weight	277.2957
SMILES	S(C)(=O)(=O)C1=CC=C(C=C1)C1=CN=CC(C(O)=O)=C1
Synonyms	893740-53-9, 5-(4-(Methylsulfonyl)phenyl)nicotinic acid, 5-(4-Methylsulfonylphenyl)nicotinic acid, 5-[4-(Methylsulfonyl)phenyl]nicotinic acid, ACMC-209r0z, CTK8B2630, DTXSID50602518, ANW-39297, MFCD06802759, ZINC16948082, AKOS004118735, AJ-69770, AX8230179, BB0223911, TC-128042, BB 0223911, ST24023746, V8813, I02-3358, 5-[4-(Methanesulfonyl)phenyl]pyridine-3-carboxylic acid, C13H11NO4S, 5-(4-(Methylsulfonyl)phenyl)nicotinicacid,

Complexity	420
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	277.041g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	277.294g/mol
Monoisotopic Mass	277.041g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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