2-(methylcarbamoyloxy)ethyl Hexanoate
Basic information
- CAS
105469-22-5- Standard SMILES
CCCCCC(=O)OCCOC(=O)NC- InChIKey
FNUBEYHVSNDZBJ-UHFFFAOYSA-N- Molecular formula
- C10H19NO4
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.13140809
Names & identifiers
- Preferred name
- 2-(methylcarbamoyloxy)ethyl Hexanoate
- IUPAC
- 2-(methylcarbamoyloxy)ethyl hexanoate
Names & synonyms
2-(methylcarbamoyloxy)ethyl Hexanoate105469-22-52-[(methylcarbamoyl)oxy]ethyl hexanoateDTXSID20147148
Database identifiers
- CAS
105469-22-5- PubChem CID
- 184499
- DTXSID
DTXSID20147148
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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