Basic information
- CAS
5131-86-2- Standard SMILES
CCCCC(=O)OCCOCCO- InChIKey
AKUBJJFUGOQWDK-UHFFFAOYSA-N- Molecular formula
- C9H18O4
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.12050905
Names & identifiers
- Preferred name
- 2-(2-Hydroxyethoxy)ethyl pentanoate
- IUPAC
- 2-(2-hydroxyethoxy)ethyl pentanoate
Names & synonyms
2-(2-HYDROXYETHOXY)ETHYL PENTANOATE5131-86-2SCHEMBL17399502DTXSID50497542
Database identifiers
- CAS
5131-86-2- PubChem CID
- 12422945
- DTXSID
DTXSID50497542
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 125
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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