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4-phenylazetidin-2-one

4-phenylazetidin-2-one

CAS: 5661-55-2

Formula: C9H9NO

SMILES: O=C1CC(N1)C1=CC=CC=C1

IUPAC: 4-phenylazetidin-2-one

InChI: InChI=1/C9H9NO/c11-9-6-8(10-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11)

Composition: C (73.45%), H (6.16%), N (9.52%), O (10.87%)

Molar Mass: 147.177

Atom Count: 20

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 147.068413914
Formal Charge 0
FSP3 0.22
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey MWKMQPSNTJCASD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.79
Topological Polar Surface Area 29.1
Polarizability 16.33
Ring Count 2
Rotatable Bond Count 1

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