2,4,6-trichlorobenzene-1,3-diol

2,4,6-trichlorobenzene-1,3-diol

CAS: 26378-73-4

Formula: C6H3Cl3O2

SMILES: OC1=C(Cl)C(O)=C(Cl)C=C1Cl

IUPAC: 2,4,6-trichlorobenzene-1,3-diol

InChI: InChI=1S/C6H3Cl3O2/c7-2-1-3(8)6(11)4(9)5(2)10/h1,10-11H

Composition: C (33.76%), H (1.42%), Cl (49.83%), O (14.99%)

Molar Mass: 213.44

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	211.9198624
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NHOATJNESSAPCQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.43
Topological Polar Surface Area	40.46
Polarizability	17.46
Ring Count	1
Rotatable Bond Count	0

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