이름: Ethyl 3-(4-aminocyclohex-1-enyl)benzoate
SMILES:
CCOC(=O)c1cccc(C2=CCC(N)CC2)c1Molecular Processing
Molecular formula
C15H19NO2
Molecular weight
245.32
Exact mass
245.1416
XLogP
2.76
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
72.2
Supplementary Information
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