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benzyl N-[(3R)-2-oxooxetan-3-yl]carbamate

benzyl N-[(3R)-2-oxooxetan-3-yl]carbamate

CAS: 98632-91-8

Formula: C11H11NO4

SMILES: O=C(N[C@@H]1COC1=O)OCC1=CC=CC=C1

IUPAC: benzyl N-[(3R)-2-oxooxetan-3-yl]carbamate

InChI: InChI=1S/C11H11NO4/c13-10-9(7-15-10)12-11(14)16-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,14)/t9-/m1/s1

Composition: C (59.73%), H (5.01%), N (6.33%), O (28.93%)

Molar Mass: 221.212

Atom Count: 27

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 221.068807838
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CWFZPRQDHIUBDO-SECBINFHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.23
Topological Polar Surface Area 64.63
Polarizability 21.53
Ring Count 2
Rotatable Bond Count 4

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