tert-butyl (2S)-4-oxo-2-phenylpyrrolidine-1-carboxylate

tert-butyl (2S)-4-oxo-2-phenylpyrrolidine-1-carboxylate

CAS: 635724-46-8

Formula: C15H19NO3

SMILES: CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C1=CC=CC=C1

IUPAC: tert-butyl (2S)-4-oxo-2-phenylpyrrolidine-1-carboxylate

InChI: InChI=1S/C15H19NO3/c1-15(2,3)19-14(18)16-10-12(17)9-13(16)11-7-5-4-6-8-11/h4-8,13H,9-10H2,1-3H3/t13-/m0/s1

Composition: C (68.94%), H (7.33%), N (5.36%), O (18.37%)

Molar Mass: 261.321

Atom Count: 38

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	261.136493476
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RDNNEKXIEMELDH-ZDUSSCGKSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.75
Topological Polar Surface Area	46.61
Polarizability	28.15
Ring Count	2
Rotatable Bond Count	3

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