Name: intermediate ( 9 )
SMILES:
CC(=O)N1c2ccc(Cl)cc2CC1C#NMolecular Processing
Molecular formula
C11H9ClN2O
Molecular weight
220.66
Exact mass
220.0403
XLogP
2.14
TPSA
44.1
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
57.72
Supplementary Information
Details werden geladen…
An 7 Reaktionen beteiligt→