이름: ethyl 2-cyanoacrylate
SMILES:
C=C(C#N)C(=O)OCCMolecular Processing
Molecular formula
C6H7NO2
Molecular weight
125.13
Exact mass
125.0477
XLogP
0.63
TPSA
50.09
H-bond donors
0
H-bond acceptors
3
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
0.333
Molar refractivity
31.39
Supplementary Information
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