2-amino-6-bromo-3,5-difluorobenzoic acid

2-amino-6-bromo-3,5-difluorobenzoic acid

Formula: C7H4BrF2NO2

SMILES: NC1=C(C(O)=O)C(Br)=C(F)C=C1F

IUPAC: 2-amino-6-bromo-3,5-difluorobenzoic acid

InChI: InChI=1S/C7H4BrF2NO2/c8-5-2(9)1-3(10)6(11)4(5)7(12)13/h1H,11H2,(H,12,13)

Composition: C (33.36%), H (1.60%), Br (31.71%), F (15.08%), N (5.56%), O (12.70%)

Molar Mass: 252.015

Atom Count: 17

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	250.939348
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YFLKVPLGEBMTCO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.07
Topological Polar Surface Area	63.32
Polarizability	16.64
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C7H4BrF2NO2		Quote Only