AG009X3T

Name: 1-(3-Methylbutyl)-3-(trifluoromethyl)pyrazole
Brand: Angene Chemical
SKU: AG009X3T

1426958-46-4 | 1-(3-Methylbutyl)-3-(trifluoromethyl)pyrazole

AG009X3T

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CAS Number	1426958-46-4
Catalog Number	AG009X3T
Chemical Name	1-(3-Methylbutyl)-3-(trifluoromethyl)pyrazole
IUPAC Name	1-(3-methylbutyl)-3-(trifluoromethyl)pyrazole
InChI	InChI=1S/C9H13F3N2/c1-7(2)3-5-14-6-4-8(13-14)9(10,11)12/h4,6-7H,3,5H2,1-2H3
InChI Key	JWCMPBUFQYDICU-UHFFFAOYSA-N
MDL Number	MFCD21668301
Molecular Formula	C9H13F3N2
Molecular Weight	206.2081
SMILES	CC(CCn1ccc(n1)C(F)(F)F)C
Synonyms	1-(3-methylbutyl)-3-(trifluoromethyl)pyrazole, 1426958-46-4, C9H13F3N2, KM3835, ZINC85020420, AKOS015358313, V3223, 1-(3-METHYLBUTYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.103g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.212g/mol
Monoisotopic Mass	206.103g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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