AG01DX96

Name: 4-cyano-1H-pyrazole-5-carboxylic acid
Brand: Angene Chemical
SKU: AG01DX96

1045733-76-3 | 4-cyano-1H-pyrazole-5-carboxylic acid

AG01DX96

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CAS Number	1045733-76-3
Catalog Number	AG01DX96
Chemical Name	4-cyano-1H-pyrazole-5-carboxylic acid
IUPAC Name	4-cyano-1H-pyrazole-5-carboxylic acid
InChI	InChI=1S/C5H3N3O2/c6-1-3-2-7-8-4(3)5(9)10/h2H,(H,7,8)(H,9,10)
InChI Key	AAXCTCRAEHZVHJ-UHFFFAOYSA-N
MDL Number	MFCD28633861
Molecular Formula	C5H3N3O2
Molecular Weight	137.0962
SMILES	OC(C1=C(C#N)C=NN1)=O
Synonyms	4-cyano-1H-pyrazole-5-carboxylic acid, 1045733-76-3, AC1LRY9X, ZINC1392195, CID1479411, 4-cyano-2H-pyrazole-3-carboxylic Acid,

Complexity	194
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.023g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	137.098g/mol
Monoisotopic Mass	137.023g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	89.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

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