الاسم: 4-oxo-adamantane-1-carboxylic acid
SMILES:
O=C1C2CC3CC1CC(C(=O)O)(C3)C2Molecular Processing
Molecular formula
C11H14O3
Molecular weight
194.23
Exact mass
194.0943
XLogP
1.47
TPSA
54.37
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
14
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
48.63
Supplementary Information
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