Nom: 2-Ethyl-7-hydroxy-2-methyl-4-chromanone
SMILES:
CCC1(C)CC(=O)c2ccc(O)cc2O1Molecular Processing
Molecular formula
C12H14O3
Molecular weight
206.24
Exact mass
206.0943
XLogP
2.53
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
56.38
Supplementary Information
Récupération des détails…
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