AG006QHX

Name: 3-Isobutyl-1H-pyrazole
Brand: Angene Chemical
SKU: AG006QHX

98816-40-1 | 3-Isobutyl-1H-pyrazole

AG006QHX

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CAS Number	98816-40-1
Catalog Number	AG006QHX(AGN-PC-0OOZU0)
Chemical Name	3-Isobutyl-1H-pyrazole
IUPAC Name	5-(2-methylpropyl)-1H-pyrazole
InChI	InChI=1S/C7H12N2/c1-6(2)5-7-3-4-8-9-7/h3-4,6H,5H2,1-2H3,(H,8,9)
InChI Key	KLQAJWMVWOATSI-UHFFFAOYSA-N
MDL Number	MFCD08701141
Molecular Formula	C7H12N2
Molecular Weight	124.1836
SMILES	CC(Cc1cc[nH]n1)C
Synonyms	3-Isobutylpyrazole, 98816-40-1, 3-ISOBUTYL-1H-PYRAZOLE, 5-(2-methylpropyl)-1H-pyrazole, SCHEMBL291612, SCHEMBL9963333, CTK8B2798, DTXSID40626208, 3-(2-Methylpropyl)-1H-pyrazole, 5899AJ, ANW-40960, KM3487, MFCD08701141, ZINC26547573, AKOS003673647, SY025165, MFCD08701141 (95%), C7H12N2,

Complexity	81
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	124.1g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	124.187g/mol
Monoisotopic Mass	124.1g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	28.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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