AG003X46

Name: 2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
Brand: Angene Chemical
SKU: AG003X46

893723-63-2 | 2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid

AG003X46

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CAS Number	893723-63-2
Catalog Number	AG003X46(AGN-PC-0WA5GB)
Chemical Name	2-(1-Benzyl-1H-pyrazol-4-yl)-isonicotinic acid
IUPAC Name	2-thiophen-3-ylpyridine-4-carboxylic acid
InChI	InChI=1S/C10H7NO2S/c12-10(13)7-1-3-11-9(5-7)8-2-4-14-6-8/h1-6H,(H,12,13)
InChI Key	BOZGVVVDIQBTDY-UHFFFAOYSA-N
MDL Number	MFCD06496474
Molecular Formula	C10H7NO2S
Molecular Weight	205.2331
SMILES	S1C=C(C=C1)C=1C=C(C(=O)O)C=CN1
Synonyms	2-(THIOPHEN-3-YL)ISONICOTINIC ACID, 893723-63-2, 2-(Thiophen-3-yl)-isonicotinic acid, ACMC-209qzw, 2-thiophen-3-ylpyridine-4-carboxylic Acid, AC1NHF42, DTXSID60406261, ANW-39258, MFCD06496474, ZINC34924631, AKOS002664569, TC-128003, V8790, 2-(thiophen-3-yl)pyridine-4-carboxylic acid, A-2872, I02-3560, F2167-2356, C10H7NO2S, CID4739104, 2-(1-BENZYL-1H-PYRAZOL-4-YL)-ISONICOTINIC ACID,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.02g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	205.231g/mol
Monoisotopic Mass	205.02g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	78.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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