SMILES:
C=CCC(C)(C)C(O)Cc1ccccc1Molecular Processing
Molecular formula
C14H20O
Molecular weight
204.31
Exact mass
204.1514
XLogP
3.19
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
64.75
Supplementary Information
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