SMILES:
CCCCCC1CCC(CCCCc2ccc(O)cc2)CC1Molecular Processing
Molecular formula
C21H34O
Molecular weight
302.5
Exact mass
302.261
XLogP
6.49
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
9
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
95.25
Supplementary Information
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