Name: isopropenyl stearate
SMILES:
C=C(C)OC(=O)CCCCCCCCCCCCCCCCCMolecular Processing
Molecular formula
C21H40O2
Molecular weight
324.55
Exact mass
324.3028
XLogP
7.32
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
17
Heavy atoms
23
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
0.857
Molar refractivity
100.45
Supplementary Information
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