CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C#N
이름: tert-butyl trans-2-cyanocyclohexylcarbamate
SMILES: CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1C#N

Molecular Processing

Molecular formula
C12H20N2O2
Molecular weight
224.3
Exact mass
224.1525
XLogP
2.59
TPSA
62.12
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
60.73

Supplementary Information

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