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2,3-dichloro-4-hydroxybenzoic acid

2,3-dichloro-4-hydroxybenzoic acid

CAS: 66584-09-6

Formula: C7H4Cl2O3

SMILES: OC(=O)C1=C(Cl)C(Cl)=C(O)C=C1

IUPAC: 2,3-dichloro-4-hydroxybenzoic acid

InChI: InChI=1S/C7H4Cl2O3/c8-5-3(7(11)12)1-2-4(10)6(5)9/h1-2,10H,(H,11,12)

Composition: C (40.62%), H (1.95%), Cl (34.25%), O (23.19%)

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 205.9537494
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey MWQVQEFJAIFHFZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.9
Topological Polar Surface Area 57.53
Polarizability 17.28
Ring Count 1
Rotatable Bond Count 1

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