Name: 5-methoxypyrazine-2-carboxylic acid
SMILES:
COc1cnc(C(=O)O)cn1Molecular Processing
Molecular formula
C6H6N2O3
Molecular weight
154.12
Exact mass
154.0378
XLogP
0.18
TPSA
72.31
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
35.54
Supplementary Information
Details werden geladen…
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