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4-(4-chlorophenyl)azetidin-2-one

4-(4-chlorophenyl)azetidin-2-one

CAS: 21161-20-6

Formula: C9H8ClNO

SMILES: ClC1=CC=C(C=C1)C1CC(=O)N1

IUPAC: 4-(4-chlorophenyl)azetidin-2-one

InChI: InChI=1/C9H8ClNO/c10-7-3-1-6(2-4-7)8-5-9(12)11-8/h1-4,8H,5H2,(H,11,12)

Composition: C (59.52%), H (4.44%), Cl (19.52%), N (7.71%), O (8.81%)

Molar Mass: 181.62

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 181.0294416
Formal Charge 0
FSP3 0.22
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey FCPWUBIYYNDWKZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.59
Topological Polar Surface Area 29.1
Polarizability 18.21
Ring Count 2
Rotatable Bond Count 1

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97% <7 Days 21161-20-6 $123.42-$4,349.62$123.42$185.13$265.54$417.95$535.76$2,229.04$4,349.62
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97% <7 Days 21161-20-6 $193.92-$439.68$193.92$290.88$439.68
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