benzyl (2S)-2-methyl-3-oxopyrrolidine-1-carboxylate

benzyl (2S)-2-methyl-3-oxopyrrolidine-1-carboxylate

CAS: 1030899-57-0

Formula: C13H15NO3

SMILES: C[C@@H]1N(CCC1=O)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl (2S)-2-methyl-3-oxopyrrolidine-1-carboxylate

InChI: InChI=1S/C13H15NO3/c1-10-12(15)7-8-14(10)13(16)17-9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3/t10-/m0/s1

Composition: C (66.94%), H (6.48%), N (6.00%), O (20.58%)

Molar Mass: 233.267

Atom Count: 32

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	233.105193347
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	SXRCSLUPXCTDRP-JTQLQIEISA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.77
Topological Polar Surface Area	46.61
Polarizability	24.47
Ring Count	2
Rotatable Bond Count	3

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