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benzyl N-[(1s,3s)-3-hydroxycyclobutyl]carbamate

benzyl N-[(1s,3s)-3-hydroxycyclobutyl]carbamate

CAS: 1403766-86-8

Formula: C12H15NO3

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

IUPAC: benzyl N-[(1s,3s)-3-hydroxycyclobutyl]carbamate

InChI: InChI=1/C12H15NO3/c14-11-6-10(7-11)13-12(15)16-8-9-4-2-1-3-5-9/h1-5,10-11,14H,6-8H2,(H,13,15)/t10-,11+

Composition: C (65.14%), H (6.83%), N (6.33%), O (21.69%)

Molar Mass: 221.256

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 221.105193347
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey BCFMGQOQYWGLIL-PHIMTYICNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.99
Topological Polar Surface Area 58.56
Polarizability 23.18
Ring Count 2
Rotatable Bond Count 4

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