이름: ethyl 4-hydroxy-6-ethyl-5,6,7,8-tetrahydroquinoline-3-carboxylate
SMILES:
CCOC(=O)c1cnc2c(c1O)CC(CC)CC2Molecular Processing
Molecular formula
C14H19NO3
Molecular weight
249.31
Exact mass
249.1365
XLogP
2.48
TPSA
59.42
H-bond donors
1
H-bond acceptors
4
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
4
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
67.66
Supplementary Information
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