Name: 43
SMILES:
CC1CN(CC(=O)O)CC(C#N)=C1ClMolecular Processing
Molecular formula
C9H11ClN2O2
Molecular weight
214.65
Exact mass
214.0509
XLogP
1.04
TPSA
64.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
51.73
Supplementary Information
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