AG01BF85

Name: 1-(2,2-Difluoroethyl)-1H-pyrazole-5-carboxylic acid
Brand: Angene Chemical
SKU: AG01BF85

1342130-35-1 | 1-(2,2-Difluoroethyl)-1H-pyrazole-5-carboxylic acid

AG01BF85

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CAS Number	1342130-35-1
Catalog Number	AG01BF85(AGN-PC-0WOS8Z)
Chemical Name	1-(2,2-Difluoroethyl)-1H-pyrazole-5-carboxylic acid
IUPAC Name	2-(2,2-difluoroethyl)pyrazole-3-carboxylic acid
InChI	InChI=1S/C6H6F2N2O2/c7-5(8)3-10-4(6(11)12)1-2-9-10/h1-2,5H,3H2,(H,11,12)
InChI Key	KCLCELLKUDRQFF-UHFFFAOYSA-N
MDL Number	MFCD20331106
Molecular Formula	C6H6F2N2O2
Molecular Weight	176.1208
SMILES	C1=C(N(N=C1)CC(F)F)C(=O)O
Synonyms	1-(2,2-difluoroethyl)-1H-pyrazole-5-carboxylic acid, 1342130-35-1, SCHEMBL15897898, ZINC70707888, AKOS013772867, NE22631,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.04g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.123g/mol
Monoisotopic Mass	176.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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