2-bromo-4-(trifluoromethyl)pyridine-3-carboxylic acid

2-bromo-4-(trifluoromethyl)pyridine-3-carboxylic acid

CAS: 749875-15-8

Formula: C7H3BrF3NO2

SMILES: OC(=O)C1=C(Br)N=CC=C1C(F)(F)F

IUPAC: 2-bromo-4-(trifluoromethyl)pyridine-3-carboxylic acid

InChI: InChI=1S/C7H3BrF3NO2/c8-5-4(6(13)14)3(1-2-12-5)7(9,10)11/h1-2H,(H,13,14)

Composition: C (31.14%), H (1.12%), Br (29.59%), F (21.11%), N (5.19%), O (11.85%)

Molar Mass: 270.005

Atom Count: 17

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	268.929926
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CHJZDOUVZPWBKU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.6
Topological Polar Surface Area	50.19
Polarizability	16.58
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	749875-15-8		$85.75-$124.84$85.75$124.84