Basic information
- Standard SMILES
CCCCCCCCCCCCSCC(O)COC(C)C- InChIKey
OTQYCXFVPQEHDL-UHFFFAOYSA-N- Molecular formula
- C18H38O2S
- Average molar mass
- 318.6 g/mol
Names & identifiers
- Preferred name
- 1-(n-Dodecylthio)-3-isopropoxy-2-propanol
- IUPAC
- 1-dodecylsulfanyl-3-propan-2-yloxypropan-2-ol
Names & synonyms
SCHEMBL11732215OTQYCXFVPQEHDL-UHFFFAOYSA-N1-(n-dodecylthio)-3-isopropoxy-2-propanol
Database identifiers
- PubChem CID
- 21423964
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 54.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 198
Related reactions
1 records
Compound notes
Loading…