3-amino-4,6-dichloropyridine-2-carboxylic acid

3-amino-4,6-dichloropyridine-2-carboxylic acid

CAS: 1073182-87-2

Formula: C6H4Cl2N2O2

SMILES: NC1=C(Cl)C=C(Cl)N=C1C(O)=O

IUPAC: 3-amino-4,6-dichloropyridine-2-carboxylic acid

InChI: InChI=1S/C6H4Cl2N2O2/c7-2-1-3(8)10-5(4(2)9)6(11)12/h1H,9H2,(H,11,12)

Composition: C (34.81%), H (1.95%), Cl (34.25%), N (13.53%), O (15.46%)

Molar Mass: 207.01

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	205.9649828
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	OVJPREKPWUUJQJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.16
Topological Polar Surface Area	76.21
Polarizability	16.97
Ring Count	1
Rotatable Bond Count	1

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