4-bromo-3,5-bis(trifluoromethyl)-1H-pyrazole

4-bromo-3,5-bis(trifluoromethyl)-1H-pyrazole

CAS: 1376710-07-4

Formula: C5HBrF6N2

SMILES: FC(F)(F)C1=C(Br)C(=NN1)C(F)(F)F

IUPAC: 4-bromo-3,5-bis(trifluoromethyl)-1H-pyrazole

InChI: InChI=1S/C5HBrF6N2/c6-1-2(4(7,8)9)13-14-3(1)5(10,11)12/h(H,13,14)

Composition: C (21.22%), H (0.36%), Br (28.24%), F (40.28%), N (9.90%)

Molar Mass: 282.971

Atom Count: 15

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	281.92273
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	WRQXMZAIZDYKDF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.82
Topological Polar Surface Area	28.68
Polarizability	13.91
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	1376710-07-4		$179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70