Name: ester
SMILES:
COC(=O)c1ccc(C(=C(C)C)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1Molecular Processing
Molecular formula
C26H32O2
Molecular weight
376.54
Exact mass
376.2402
XLogP
6.66
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
116.88
Supplementary Information
Details werden geladen…
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