Nom: (2R, 5S, 6R)-2-trichloromethyl-5,6-dimethyl-1,3-dioxan -4-one
SMILES:
C[C@@H]1C(=O)O[C@H](C(Cl)(Cl)Cl)O[C@@H]1CMolecular Processing
Molecular formula
C7H9Cl3O3
Molecular weight
247.5
Exact mass
245.9617
XLogP
2.28
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
49.88
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→