Name: 2-methyl-1-phenylpropan-2-yl 2-((4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate
SMILES:
CC(C)(Cc1ccccc1)OC(=O)C[C@H]1C[C@@H](CCl)OC(C)(C)O1Molecular Processing
Molecular formula
C19H27ClO4
Molecular weight
354.87
Exact mass
354.1598
XLogP
4.09
TPSA
44.76
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
94.1
Supplementary Information
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