2-chlorobenzene-1,3,5-triol

2-chlorobenzene-1,3,5-triol

CAS: 84743-76-0

Formula: C6H5ClO3

SMILES: OC1=CC(O)=C(Cl)C(O)=C1

IUPAC: 2-chlorobenzene-1,3,5-triol

InChI: InChI=1S/C6H5ClO3/c7-6-4(9)1-3(8)2-5(6)10/h1-2,8-10H

Composition: C (44.89%), H (3.14%), Cl (22.08%), O (29.89%)

Molar Mass: 160.55

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	159.9927217
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	XHGZCXPDKIEKNY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.81
Topological Polar Surface Area	60.69
Polarizability	14.16
Ring Count	1
Rotatable Bond Count	0

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