2-amino-6-bromo-3-chlorobenzoic acid

2-amino-6-bromo-3-chlorobenzoic acid

CAS: 1340518-19-5

Formula: C7H5BrClNO2

SMILES: NC1=C(C(O)=O)C(Br)=CC=C1Cl

IUPAC: 2-amino-6-bromo-3-chlorobenzoic acid

InChI: InChI=1S/C7H5BrClNO2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,10H2,(H,11,12)

Composition: C (33.57%), H (2.01%), Br (31.90%), Cl (14.15%), N (5.59%), O (12.77%)

Molar Mass: 250.48

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	248.919219
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	TZHCKHYMRRCAKE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.44
Topological Polar Surface Area	63.32
Polarizability	18.78
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	1340518-19-5		$268.76-$1,010.56$268.76$268.76$429.35$429.35$1,010.56$1,010.56