SMILES:
O=C1OC(CCc2ccccc2)(c2ccccc2)CC(O)=C1BrMolecular Processing
Molecular formula
C19H17BrO3
Molecular weight
373.25
Exact mass
372.0361
XLogP
4.63
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
92.17
Supplementary Information
Récupération des détails…
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