이름: 2-Hydroxyimino-4-p-tolyl-but-3-enenitrile
SMILES:
Cc1ccc(C=CC(C#N)=NO)cc1Molecular Processing
Molecular formula
C11H10N2O
Molecular weight
186.21
Exact mass
186.0793
XLogP
2.36
TPSA
56.38
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
55.05
Supplementary Information
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