Basic information
- CAS
624-07-7- Standard SMILES
CCCCCCCCCCCC(=O)OCCCCOC(=O)CCCCCCCCCCC- InChIKey
QILMKHPBHSTXSI-UHFFFAOYSA-N- Molecular formula
- C28H54O4
- Average molar mass
- 454.7 g/mol
- Monoisotopic mass
- 454.4022102
Names & identifiers
- Preferred name
- Dodecanoic acid, 1,1'-(1,4-butanediyl) ester
- IUPAC
- 4-dodecanoyloxybutyl dodecanoate
- English name
- Dilauric acid 1,4-butanediyl
- Molecular formula
- C28H54O4
- Molecular weight
- 454.72596
Names & synonyms
Dodecanoic acid, 1,4-butanediyl esterDTXSID9060780Dodecanoic acid, 1,1'-(1,4-butanediyl) esterRefChem:135437DTXCID7043328butane-1,4-diyl didodecanoate624-07-7SCHEMBL2113872QILMKHPBHSTXSI-UHFFFAOYSA-NDiethylene dilaurateDilauric acid 1,4-butanediylBisdodecanoic acid 1,4-butanediyl
Database identifiers
- CAS
624-07-7- PubChem CID
- 69349
- DTXSID
DTXSID9060780- Nikkaji
- J135.632A
Properties
Computed structural properties
- XLogP
- 11
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 27
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- EPA Substance Registry System
- 1 · Dodecanoic acid, 1,4-butanediyl ester (624-07-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Dodecanoic acid, 1,4-butanediyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationDodecanoic acid, 1,1'-(1,4-butanediyl) ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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