Basic information
- Standard SMILES
CCCC(=O)OCC(OCC)OCC- InChIKey
VTNSLLLTSAGIHY-UHFFFAOYSA-N- Molecular formula
- C10H20O4
- Average molar mass
- 204.26 g/mol
Names & identifiers
- Preferred name
- 2,2-diethoxyethyl Butanoate
- IUPAC
- 2,2-diethoxyethyl butanoate
Names & synonyms
2,2-diethoxyethyl ButanoateSCHEMBL1842052SCHEMBL4849685VTNSLLLTSAGIHY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 11264175
- Nikkaji
- J2.066.569F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 141
Related reactions
9 records
Compound notes
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