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4-(4-chlorobenzoyl)phenol

4-(4-chlorobenzoyl)phenol

CAS: 42019-78-3

Formula: C13H9ClO2

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

IUPAC: 4-(4-chlorobenzoyl)phenol

InChI: InChI=1S/C13H9ClO2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,15H

Composition: C (67.11%), H (3.90%), Cl (15.24%), O (13.75%)

Molar Mass: 232.66

Atom Count: 25

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 232.0291072
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey RUETVLNXAGWCDS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.42
Topological Polar Surface Area 37.3
Polarizability 24.44
Ring Count 2
Rotatable Bond Count 2

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