Nombre: 4-amino-1,2,4-triazole acetonitrile
SMILES:
CC#N.Nn1cnnc1Molecular Processing
Molecular formula
C4H7N5
Molecular weight
125.13
Exact mass
125.0701
XLogP
-0.48
TPSA
80.52
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.25
Molar refractivity
31.46
Supplementary Information
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