1,1'-Oxydioctan-2-ol
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Basic information
- CAS
21875-81-0- Standard SMILES
CCCCCCC(O)COCC(O)CCCCCC- InChIKey
TVPBCGITZQHSSI-UHFFFAOYSA-N- Molecular formula
- C16H34O3
- Average molar mass
- 274.44 g/mol
- Monoisotopic mass
- 274.25079494
Names & identifiers
- Preferred name
- 1,1'-Oxydioctan-2-ol
- IUPAC
- 1-(2-hydroxyoctoxy)octan-2-ol
- English name
- 1,1'-oxydioctan-2-ol
- Molecular formula
- C16H34O3
- Molecular weight
- 274.43936
Names & synonyms
1,1'-Oxydioctan-2-ol21875-81-0EINECS 244-624-31,1'-Oxydi(octan-2-ol)SCHEMBL8189807DTXSID40944474TVPBCGITZQHSSI-UHFFFAOYSA-NNS000500281,1'-Oxybis(2-octanol)
Database identifiers
- CAS
21875-81-0- PubChem CID
- 89545
- DTXSID
DTXSID40944474- EC Number
- 244-624-3
- Nikkaji
- J225.464F
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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