Name: 7-hydroxyindole-2-carboxylic acid n-butyl ester
SMILES:
CCCCOC(=O)c1cc2cccc(O)c2[nH]1Molecular Processing
Molecular formula
C13H15NO3
Molecular weight
233.27
Exact mass
233.1052
XLogP
2.83
TPSA
62.32
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
65.15
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→