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benzyl N-[(2S)-1-oxo-3-phenylpropan-2-yl]carbamate

benzyl N-[(2S)-1-oxo-3-phenylpropan-2-yl]carbamate

CAS: 59830-60-3

Formula: C17H17NO3

SMILES: O=C[C@H](CC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1

IUPAC: benzyl N-[(2S)-1-oxo-3-phenylpropan-2-yl]carbamate

InChI: InChI=1S/C17H17NO3/c19-12-16(11-14-7-3-1-4-8-14)18-17(20)21-13-15-9-5-2-6-10-15/h1-10,12,16H,11,13H2,(H,18,20)/t16-/m0/s1

Composition: C (72.07%), H (6.05%), N (4.94%), O (16.94%)

Molar Mass: 283.327

Atom Count: 38

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 283.120843411
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HZDPJHOWPIVWMR-INIZCTEOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.87
Topological Polar Surface Area 55.4
Polarizability 31.1
Ring Count 2
Rotatable Bond Count 7

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