AG00G3VZ

Name: 2-((Difluoromethyl)thio)nicotinic acid
Brand: Angene Chemical
SKU: AG00G3VZ

852706-16-2 | 2-((Difluoromethyl)thio)nicotinic acid

AG00G3VZ

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CAS Number	852706-16-2
Catalog Number	AG00G3VZ(AGN-PC-0WOBCL)
Chemical Name	2-((Difluoromethyl)thio)nicotinic acid
IUPAC Name	2-(difluoromethylsulfanyl)pyridine-3-carboxylic acid
InChI	InChI=1S/C7H5F2NO2S/c8-7(9)13-5-4(6(11)12)2-1-3-10-5/h1-3,7H,(H,11,12)
InChI Key	LUIBZYAYEDRJQB-UHFFFAOYSA-N
MDL Number	MFCD06655574
Molecular Formula	C7H5F2NO2S
Molecular Weight	205.1819
SMILES	C1=CC(=C(N=C1)SC(F)F)C(=O)O
Synonyms	2-[(difluoromethyl)thio]nicotinic acid, 852706-16-2, 2-[(difluoromethyl)sulfanyl]pyridine-3-carboxylic acid, 2-((Difluoromethyl)thio)nicotinic acid, 2-(difluoromethylsulfanyl)pyridine-3-carboxylic Acid, AC1NLQ6F, AC1Q72KT, CTK7B7681, ZINC4206002, MFCD06655574, AKOS008987645, MCULE-9433258443, NE24055, NCGC00322997-01, EN300-12936, AB01318292-02, J-507615, Z85937426, CID4962140,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.001g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.179g/mol
Monoisotopic Mass	205.001g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	75.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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