3-bromo-6-chloro-2-fluorobenzoic acid

3-bromo-6-chloro-2-fluorobenzoic acid

CAS: 702640-51-5

Formula: C7H3BrClFO2

SMILES: OC(=O)C1=C(Cl)C=CC(Br)=C1F

IUPAC: 3-bromo-6-chloro-2-fluorobenzoic acid

InChI: InChI=1S/C7H3BrClFO2/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2H,(H,11,12)

Composition: C (33.17%), H (1.19%), Br (31.53%), Cl (13.99%), F (7.50%), O (12.62%)

Molar Mass: 253.45

Atom Count: 15

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	251.898898
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RMFKXLDHDDWWGR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.96
Topological Polar Surface Area	37.3
Polarizability	17.54
Ring Count	1
Rotatable Bond Count	1

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97%	<7 Days	702640-51-5		$53.30-$1,247.29$53.30$178.59$320.71$785.40$1,247.29

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	702640-51-5		$51.35-$2,346.69$51.35$63.37$86.31$251.28$726.51$2,346.69