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Basic information
- Standard SMILES
COC(COCCCCCCCCCCCCC1CCCCC1)CS(=O)(=O)CCCO- InChIKey
APMHWZWPNUYKGI-UHFFFAOYSA-N- Molecular formula
- C25H50O5S
- Average molar mass
- 462.7 g/mol
- Monoisotopic mass
- 462.33789586
Names & identifiers
- Preferred name
- 2-Methoxy-3-(12-cyclohexyldodecyloxy)propyl 3-hydroxypropyl sulfone
- IUPAC
- 3-[3-(12-cyclohexyldodecoxy)-2-methoxypropyl]sulfonylpropan-1-ol
Names & synonyms
SCHEMBL10552372APMHWZWPNUYKGI-UHFFFAOYSA-N2-methoxy-3-(12-cyclohexyldodecyloxy)propyl 3-hydroxypropyl sulfone
Database identifiers
- PubChem CID
- 53655331
Properties
Computed structural propertiesFilling in
- XLogP
- 7.4
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 21
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 483
Related reactions
2 records
Compound notes
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