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benzyl 1-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate

benzyl 1-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate

CAS: 914389-34-7

Formula: C14H16N2O3

SMILES: O=C(OCC1=CC=CC=C1)N1CCCC11CNC1=O

IUPAC: benzyl 1-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate

InChI: InChI=1/C14H16N2O3/c17-12-14(10-15-12)7-4-8-16(14)13(18)19-9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,15,17)

Composition: C (64.60%), H (6.20%), N (10.76%), O (18.44%)

Molar Mass: 260.293

Atom Count: 35

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 260.116092383
Formal Charge 0
FSP3 0.43
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZNBUBJKKAJDWOO-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.58
Topological Polar Surface Area 58.64
Polarizability 26.73
Ring Count 3
Rotatable Bond Count 3

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