AG00JEVM

Name: 1-butyl-1H-pyrazole-5-carboxylic acid
Brand: Angene Chemical
SKU: AG00JEVM

1006493-81-7 | 1-butyl-1H-pyrazole-5-carboxylic acid

AG00JEVM

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CAS Number	1006493-81-7
Catalog Number	AG00JEVM(AGN-PC-0WBAN3)
Chemical Name	1-butyl-1H-pyrazole-5-carboxylic acid
IUPAC Name	2-butylpyrazole-3-carboxylic acid
InChI	InChI=1S/C8H12N2O2/c1-2-3-6-10-7(8(11)12)4-5-9-10/h4-5H,2-3,6H2,1H3,(H,11,12)
InChI Key	GPCNIDIHJOJQFF-UHFFFAOYSA-N
MDL Number	MFCD06805232
Molecular Formula	C8H12N2O2
Molecular Weight	168.1931
SMILES	CCCCN1C(C(O)=O)=CC=N1
Synonyms	1-butyl-1H-pyrazole-5-carboxylic acid, 1006493-81-7, 1-butylpyrazole-5-carboxylic acid, CTK6E2672, MFCD06805232, SBB022925, STK350117, ZINC12357785, AKOS000308837, MCULE-2649147219, ST45128105, EN300-92704, XXB,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.09g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	168.196g/mol
Monoisotopic Mass	168.09g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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