4-amino-2-bromopyridine-3-carboxylic acid

4-amino-2-bromopyridine-3-carboxylic acid

CAS: 1060809-71-3

Formula: C6H5BrN2O2

SMILES: NC1=C(C(O)=O)C(Br)=NC=C1

IUPAC: 4-amino-2-bromopyridine-3-carboxylic acid

InChI: InChI=1S/C6H5BrN2O2/c7-5-4(6(10)11)3(8)1-2-9-5/h1-2H,(H2,8,9)(H,10,11)

Composition: C (33.21%), H (2.32%), Br (36.82%), N (12.91%), O (14.74%)

Molar Mass: 217.022

Atom Count: 16

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	215.95344
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	KVJIJXPIWHSDFE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.32
Topological Polar Surface Area	76.21
Polarizability	16.05
Ring Count	1
Rotatable Bond Count	1

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95%	<5 Days	1060809-71-3		$274.90-$320.29$274.90$320.29