Name: α-Bromo-3-hydroxytricyclo[3.3.1.13,7]decane-1-acetic acid
SMILES:
O=C(O)C(Br)C12CC3CC(CC(O)(C3)C1)C2Molecular Processing
Molecular formula
C12H17BrO3
Molecular weight
289.17
Exact mass
288.0361
XLogP
2.17
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.917
Molar refractivity
62.42
Supplementary Information
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Involved in 9 reactions→