Basic information
- CAS
14295-64-8- Standard SMILES
CC(C)C(=O)OCC(COC(=O)C(C)C)OC(=O)C(C)C- InChIKey
REAAUFDFYPKMIR-UHFFFAOYSA-N- Molecular formula
- C15H26O6
- Average molar mass
- 302.36 g/mol
- Monoisotopic mass
- 302.17293854
Names & identifiers
- Preferred name
- Glycerol triisobutyrate
- IUPAC
- 2,3-bis(2-methylpropanoyloxy)propyl 2-methylpropanoate
- English name
- glycerol triisobutyrate
- Molecular formula
- C15H26O6
- Molecular weight
- 302.36
Names & synonyms
Glycerol triisobutyrate14295-64-8propane-1,2,3-triyl tris(2-methylpropanoate)2,3-bis(2-methylpropanoyloxy)propyl 2-methylpropanoateEINECS 238-224-8TriisobutyrinSCHEMBL2402152glycerol tri(2 methylpropanoate)DTXSID90931697NS00053909propane-1,2,3-triyltris(2-methylpropanoate)Propanoic acid, 2-methyl-, 1,2,3-propanetriyl ester
Show more names
Tris(2-methylpropanoic acid)1,2,3-propanetriyl esterPropanoic acid,2-methyl-, 1,1',1''-(1,2,3-propanetriyl) ester
Database identifiers
- CAS
14295-64-8- PubChem CID
- 84332
- DTXSID
DTXSID90931697- EC Number
- 238-224-8
- Nikkaji
- J216.947I
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- Boiling point
- 327.7 · 327.7±9.0 °C(Predicted)
- Density
- 1.049 · 1.049±0.06 g/cm3(Predicted)
Chemistry & industry
Applications
UsesTriisobutyrin is used in the preparation of low-molecular weight glycerol triesters as plasticizers for poly(vinyl chloride).
Suppliers3 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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