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tert-butyl N-[(3-hydroxyoxetan-3-yl)methyl]carbamate

tert-butyl N-[(3-hydroxyoxetan-3-yl)methyl]carbamate

CAS: 1408076-45-8

Formula: C9H17NO4

SMILES: CC(C)(C)OC(=O)NCC1(O)COC1

IUPAC: tert-butyl N-[(3-hydroxyoxetan-3-yl)methyl]carbamate

InChI: InChI=1S/C9H17NO4/c1-8(2,3)14-7(11)10-4-9(12)5-13-6-9/h12H,4-6H2,1-3H3,(H,10,11)

Composition: C (53.19%), H (8.43%), N (6.89%), O (31.49%)

Molar Mass: 203.238

Atom Count: 31

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 203.115758031
Formal Charge 0
FSP3 0.89
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey AOZVJTNFMKPQPK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.72
Topological Polar Surface Area 67.79
Polarizability 19.88
Ring Count 1
Rotatable Bond Count 4

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