Dipentyl adipate
Basic information
- CAS
14027-78-2- Standard SMILES
CCCCCOC(=O)CCCCC(=O)OCCCCC- InChIKey
UPPJFVSCGFPFHM-UHFFFAOYSA-N- Molecular formula
- C16H30O4
- Average molar mass
- 286.41 g/mol
- Monoisotopic mass
- 286.21440943
Names & identifiers
- Preferred name
- Dipentyl adipate
- IUPAC
- dipentyl hexanedioate
- English name
- dipentyl adipate
- Molecular formula
- C16H30O4
- Molecular weight
- 286.407
Names & synonyms
DIPENTYL ADIPATEDipentyl hexanedioate14027-78-2hexanedioic acid dipentyl esterEINECS 237-866-6Adipic acid, dipentyl esterSCHEMBL1419432SCHEMBL7332890DTXSID50161291NS00024545Q65224700Adipic acid dipentyl ester
Database identifiers
- CAS
14027-78-2- PubChem CID
- 26404
- DTXSID
DTXSID50161291- EC Number
- 237-866-6
- Nikkaji
- J125.430H
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 225
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- LogP
- 5.026 · 5.026 (est)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…