1-(3-acetylphenyl)-3,3-dimethylazetidin-2-one

1-(3-acetylphenyl)-3,3-dimethylazetidin-2-one

CAS: 453557-75-0

Formula: C13H15NO2

SMILES: CC(=O)C1=CC=CC(=C1)N1CC(C)(C)C1=O

IUPAC: 1-(3-acetylphenyl)-3,3-dimethylazetidin-2-one

InChI: InChI=1S/C13H15NO2/c1-9(15)10-5-4-6-11(7-10)14-8-13(2,3)12(14)16/h4-7H,8H2,1-3H3

Composition: C (71.87%), H (6.96%), N (6.45%), O (14.73%)

Molar Mass: 217.268

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	217.110278727
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DRMPHEAXNKBGIA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.66
Topological Polar Surface Area	37.38
Polarizability	23.73
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	453557-75-0		$51.35-$180.26$51.35$63.37$86.31$113.62$180.26