Cc1ccc(S(=O)(=O)OC[C@@H](C)OC2CCCCO2)cc1
Name: (2R)-2-(tetrahydro-2H-pyran-2-yloxy)propyl 4-methylbenzenesulfonate
SMILES: Cc1ccc(S(=O)(=O)OC[C@@H](C)OC2CCCCO2)cc1

Molecular Processing

Molecular formula
C15H22O5S
Molecular weight
314.4
Exact mass
314.1188
XLogP
2.63
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
78.45

Supplementary Information

Details werden geladen…

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