Name: chloroformylacetonitrile
SMILES:
N#CCC(=O)ClMolecular Processing
Molecular formula
C3H2ClNO
Molecular weight
103.51
Exact mass
102.9825
XLogP
0.67
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
6
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
21.09
Supplementary Information
Details werden geladen…
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