Name: heptyl isocyanate
SMILES:
CCCCCCCN=C=OMolecular Processing
Molecular formula
C8H15NO
Molecular weight
141.21
Exact mass
141.1154
XLogP
2.29
TPSA
29.43
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
41.75
Supplementary Information
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Involved in 65 reactions→