3,6,9-Trioxa-12-azaicosan-1-ol
Basic information
- CAS
123117-69-1- Standard SMILES
CCCCCCCCNCCOCCOCCOCCO- InChIKey
ATJKEOXQOWIKNN-UHFFFAOYSA-N- Molecular formula
- C16H35NO4
- Average molar mass
- 305.45 g/mol
- Monoisotopic mass
- 305.2566086
Names & identifiers
- Preferred name
- 3,6,9-Trioxa-12-azaicosan-1-ol
- IUPAC
- 2-[2-[2-[2-(octylamino)ethoxy]ethoxy]ethoxy]ethanol
Names & synonyms
123117-69-1DTXSID808676183,6,9-Trioxa-12-azaicosan-1-ol
Database identifiers
- CAS
123117-69-1- PubChem CID
- 85601650
- DTXSID
DTXSID80867618
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 18
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 182
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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