Basic information
- CAS
5401-01-4- Standard SMILES
CCCCOC(=O)C(C)OC(=O)OCCOCCOC(=O)OCC(CC)CC- InChIKey
ZARDWFRCSAPGGQ-UHFFFAOYSA-N- Molecular formula
- C19H34O9
- Average molar mass
- 406.5 g/mol
- Monoisotopic mass
- 406.22028266
Names & identifiers
- Preferred name
- Butyl 2-[2-[2-(2-ethylbutoxycarbonyloxy)ethoxy]ethoxycarbonyloxy]propanoate
- IUPAC
- butyl 2-[2-[2-(2-ethylbutoxycarbonyloxy)ethoxy]ethoxycarbonyloxy]propanoate
Names & synonyms
5401-01-4NSC2423butyl 15-ethyl-2-methyl-4,12-dioxo-3,5,8,11,13-pentaoxaheptadecan-1-oatebutyl 2-[2-[2-(2-ethylbutoxycarbonyloxy)ethoxy]ethoxycarbonyloxy]propanoateDTXSID30277465NSC-2423BIS(2-HYDROXYETHYL)ETHER, 2-ETHYLBUTYL ESTER, ESTER WITH BUTYL LACTATE
Database identifiers
- CAS
5401-01-4- PubChem CID
- 220129
- DTXSID
DTXSID30277465
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 20
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 435
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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