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3-(3-chlorophenyl)cyclobutan-1-one

3-(3-chlorophenyl)cyclobutan-1-one

CAS: 152714-08-4

Formula: C10H9ClO

SMILES: ClC1=CC=CC(=C1)C1CC(=O)C1

IUPAC: 3-(3-chlorophenyl)cyclobutan-1-one

InChI: InChI=1S/C10H9ClO/c11-9-3-1-2-7(4-9)8-5-10(12)6-8/h1-4,8H,5-6H2

Composition: C (66.49%), H (5.02%), Cl (19.63%), O (8.86%)

Molar Mass: 180.63

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 180.0341926
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey MPIYPDUURJOKRP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.49
Topological Polar Surface Area 17.07
Polarizability 18.9
Ring Count 2
Rotatable Bond Count 1

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