이름: N-isopropylcyanoacetamide
SMILES:
CC(C)NC(=O)CC#NMolecular Processing
Molecular formula
C6H10N2O
Molecular weight
126.16
Exact mass
126.0793
XLogP
0.42
TPSA
52.89
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
33.51
Supplementary Information
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