Name: 1,4-adamantanediol
SMILES:
OC1C2CC3CC1CC(O)(C3)C2Molecular Processing
Molecular formula
C10H16O2
Molecular weight
168.24
Exact mass
168.115
XLogP
0.92
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
44.51
Supplementary Information
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