Name: (6R/S,9R)-6-methyl-9-(1-methylvinyl)-bicyclo[4,4,0]dec-1-ene-3-one
SMILES:
C=C(C)[C@@H]1CCC2(C)CCC(=O)C=C2C1Molecular Processing
Molecular formula
C14H20O
Molecular weight
204.31
Exact mass
204.1514
XLogP
3.66
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
62.59
Supplementary Information
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