AG019U87

Name: 2-{[(4-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylic acid
Brand: Angene Chemical
SKU: AG019U87

460736-49-6 | 2-{[(4-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylic acid

AG019U87

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CAS Number	460736-49-6
Catalog Number	AG019U87(AGN-PC-0WCOGC)
Chemical Name	2-{[(4-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylic acid
IUPAC Name	2-[(4-fluorophenyl)methylsulfanyl]pyridine-3-carboxylic acid
InChI	InChI=1S/C13H10FNO2S/c14-10-5-3-9(4-6-10)8-18-12-11(13(16)17)2-1-7-15-12/h1-7H,8H2,(H,16,17)
InChI Key	NKKMJXDCMFNXOS-UHFFFAOYSA-N
MDL Number	MFCD03123099
Molecular Formula	C13H10FNO2S
Molecular Weight	263.2874
SMILES	OC(C1=C(SCC2=CC=C(F)C=C2)N=CC=C1)=O
Synonyms	2-[(4-fluorobenzyl)thio]nicotinic acid, 460736-49-6, 2-{[(4-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylic acid, 2-[(4-fluorophenyl)methylsulfanyl]pyridine-3-carboxylic Acid, AC1LH9U0, AC1Q72MB, CTK7C0606, HMS1659D19, ZINC415197, STK922194, AKOS000139962, MCULE-7705498167, 2-(4-Fluoro-benzylsulfanyl)-nicotinic acid, ST50146795, EN300-40871, VU0512850-1, L-4642, 2-[(4-fluorobenzyl)sulfanyl]pyridine-3-carboxylic acid, 2-[(4-fluorophenyl)methylthio]pyridine-3-carboxylic acid, F3183-0009, CID859339,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.042g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	263.286g/mol
Monoisotopic Mass	263.042g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	75.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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