Name: 2-amino-2,3-dimethylbutyronitrile
SMILES:
CC(C)C(C)(N)C#NMolecular Processing
Molecular formula
C6H12N2
Molecular weight
112.18
Exact mass
112.1
XLogP
0.88
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
33.04
Supplementary Information
Details werden geladen…
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