名称: 5-(difluoromethyl)pyrazine-2-carboxylic acid
SMILES:
O=C(O)c1cnc(C(F)F)cn1Molecular Processing
Molecular formula
C6H4F2N2O2
Molecular weight
174.11
Exact mass
174.0241
XLogP
1.11
TPSA
63.08
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
33.95
Supplementary Information
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