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tert-butyl N-[(1S)-3-oxocyclohexyl]carbamate

tert-butyl N-[(1S)-3-oxocyclohexyl]carbamate

CAS: 1803033-61-5

Formula: C11H19NO3

SMILES: CC(C)(C)OC(=O)N[C@H]1CCCC(=O)C1

IUPAC: tert-butyl N-[(1S)-3-oxocyclohexyl]carbamate

InChI: InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-8-5-4-6-9(13)7-8/h8H,4-7H2,1-3H3,(H,12,14)/t8-/m0/s1

Composition: C (61.95%), H (8.98%), N (6.57%), O (22.50%)

Molar Mass: 213.277

Atom Count: 34

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 213.136493476
Formal Charge 0
FSP3 0.82
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey VGDCXKATFLOEHF-QMMMGPOBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.29
Topological Polar Surface Area 55.4
Polarizability 22.26
Ring Count 1
Rotatable Bond Count 3

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