Name: 6,11-dihydro-1,4-dimethyldibenz[b,e]oxepin-11-carboxylic acid
SMILES:
Cc1ccc(C)c2c1OCc1ccccc1C2C(=O)OMolecular Processing
Molecular formula
C17H16O3
Molecular weight
268.31
Exact mass
268.1099
XLogP
3.41
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
76.17
Supplementary Information
Details werden geladen…
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