Name: 2-cyanoethyl 3-aminocrotonate
SMILES:
C/C(N)=C/C(=O)OCCC#NMolecular Processing
Molecular formula
C7H10N2O2
Molecular weight
154.17
Exact mass
154.0742
XLogP
0.31
TPSA
76.11
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
39.13
Supplementary Information
Details werden geladen…
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