Nombre: 7-ethoxymethylxanthine
SMILES:
CCOCn1cnc2[nH]c(=O)[nH]c(=O)c21Molecular Processing
Molecular formula
C8H10N4O3
Molecular weight
210.19
Exact mass
210.0753
XLogP
-0.59
TPSA
92.77
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
52.6
Supplementary Information
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