4,6-diaminobenzene-1,3-diol dihydrochloride

4,6-diaminobenzene-1,3-diol dihydrochloride

CAS: 16523-31-2

Formula: C6H10Cl2N2O2

SMILES: Cl.Cl.NC1=CC(N)=C(O)C=C1O

IUPAC: 4,6-diaminobenzene-1,3-diol dihydrochloride

InChI: InChI=1S/C6H8N2O2.2ClH/c7-3-1-4(8)6(10)2-5(3)9;;/h1-2,9-10H,7-8H2;2*1H

Composition: C (33.82%), H (4.73%), Cl (33.28%), N (13.15%), O (15.02%)

Molar Mass: 213.06

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	212.011933
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
InChIKey	KUMOYHHELWKOCB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.42
Topological Polar Surface Area	92.5
Polarizability	13.85
Ring Count	1
Rotatable Bond Count	0

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