Name: 5-(3-Amino-2-methoxy-phenyl)-furan-2-carboxylic acid
SMILES:
COc1c(N)cccc1-c1ccc(C(=O)O)o1Molecular Processing
Molecular formula
C12H11NO4
Molecular weight
233.22
Exact mass
233.0688
XLogP
2.24
TPSA
85.69
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
62.07
Supplementary Information
Details werden geladen…
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