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2-chloro-5-hydroxybenzoic acid

2-chloro-5-hydroxybenzoic acid

CAS: 56961-30-9

Formula: C7H5ClO3

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

IUPAC: 2-chloro-5-hydroxybenzoic acid

InChI: InChI=1S/C7H5ClO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,(H,10,11)

Composition: C (48.72%), H (2.92%), Cl (20.54%), O (27.81%)

Molar Mass: 172.56

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 171.9927217
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey UTVCLUZQPSRKMY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.1
Topological Polar Surface Area 57.53
Polarizability 15.26
Ring Count 1
Rotatable Bond Count 1

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