Nom: 6-bromo-3′-tert-butylspiro[chroman-2,1′-cyclopentan]-4-one
SMILES:
CC(C)(C)C1CCC2(CC(=O)c3cc(Br)ccc3O2)C1Molecular Processing
Molecular formula
C17H21BrO2
Molecular weight
337.26
Exact mass
336.0725
XLogP
5
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
83.24
Supplementary Information
Récupération des détails…
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