| Typical physical and chemical properties | |
|---|---|
| Catalog Number | ACM19074249-1 |
| Product Name | Dodecanedioic acid, 1,12-bis(2-ethylhexyl) ester |
| CAS | 19074-24-9 |
| Structure |  |
| Synonyms | Di(2-ethylhexyl) dodecanedioate |
| IUPAC Name | Bis(2-ethylhexyl) dodecanedioate |
| Molecular Weight | 454.7 |
| Molecular Formula | C28H54O4 |
| Canonical SMILES | CCCCC(CC)COC(=O)CCCCCCCCCCC(=O)OCC(CC)CCCC |
| InChI | InChI=1S/C28H54O4/c1-5-9-19-25(7-3)23-31-27(29)21-17-15-13-11-12-14-16-18-22-28(30)32-24-26(8-4)20-10-6-2/h25-26H,5-24H2,1-4H3 |
| InChIKey | MTPSFISGWJGUGN-UHFFFAOYSA-N |
| Boiling Point | 267 °C |
| Flash Point | 230 °C |
| Purity | 94%+ |
| Density | 0.91 g/mL |
| Complexity | 395 |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 454.4022102 |
| Formal Charge | 0 |
| Heavy Atom Count | 32 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Monoisotopic Mass | 454.4022102 |
| Physical State | Liquid |
| Rotatable Bond Count | 25 |
| Topological Polar Surface Area | 52.6 Ų |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| MSDS | Download MSDS |
| COA | Download COA |
| Spec Sheet | Download Spec Sheet |
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