1-benzyl-3-hydroxy-4,4-dimethylpyrrolidin-2-one

1-benzyl-3-hydroxy-4,4-dimethylpyrrolidin-2-one

CAS: 565430-90-2

Formula: C13H17NO2

SMILES: CC1(C)CN(CC2=CC=CC=C2)C(=O)C1O

IUPAC: 1-benzyl-3-hydroxy-4,4-dimethylpyrrolidin-2-one

InChI: InChI=1/C13H17NO2/c1-13(2)9-14(12(16)11(13)15)8-10-6-4-3-5-7-10/h3-7,11,15H,8-9H2,1-2H3

Composition: C (71.21%), H (7.81%), N (6.39%), O (14.59%)

Molar Mass: 219.284

Atom Count: 33

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	219.125928791
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QGIAXCPKXOERCB-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.98
Topological Polar Surface Area	40.54
Polarizability	24.31
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	565430-90-2		$126.10-$624.20$126.10$378.30$624.20