2-(2-Nonanoyloxypropanoylamino)ethyl nonanoate
Basic information
- CAS
6288-30-8- Standard SMILES
CCCCCCCCC(=O)OCCNC(=O)C(C)OC(=O)CCCCCCCC- InChIKey
GIBWHSWUGMFLGQ-UHFFFAOYSA-N- Molecular formula
- C23H43NO5
- Average molar mass
- 413.6 g/mol
- Monoisotopic mass
- 413.31412347
Names & identifiers
- Preferred name
- 2-(2-Nonanoyloxypropanoylamino)ethyl nonanoate
- IUPAC
- 2-(2-nonanoyloxypropanoylamino)ethyl nonanoate
Names & synonyms
6288-30-82-(2-nonanoyloxypropanoylamino)ethyl nonanoateNSC120831-{[2-(nonanoyloxy)ethyl]amino}-1-oxopropan-2-yl nonanoateDTXSID70279286NSC-12083
Database identifiers
- CAS
6288-30-8- PubChem CID
- 223965
- DTXSID
DTXSID70279286
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 81.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 21
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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