2,2,4-Trimethyl-1,3-pentanediol monoisobutyrate
SIGALD/538221 - mixture of isomers, 99%
CAS Number: 25265-77-4
Empirical Formula (Hill Notation): C12H24O3
Molecular Weight: 216.32
EC Number: 246-771-9
MDL Number: MFCD00148967
Linear Formula: (CH3)2CHCH[O(R)]C(CH3)2CH2O(R), R=-COCH(CH3)2 or H
Product Type: Chemical
| assay | 99% |
| bp | 255 °C (lit.) |
| density | 0.95 g/mL at 25 °C (lit.) |
| form | liquid |
| impurities | ≤0.10% (water) |
| InChI | 1S/C12H24O3/c1-8(2)10(13) |
| InChI key | DAFHKNAQFPVRKR-UHFFFAOYSA |
| mp | −50 °C (lit.) |
| Quality Level | 200 ![]() |
| refractive index | n |
| SMILES string | O(CC(C(O)C(C)C)(C)C)C(=O) |
| technique(s) | GC/MS: suitable |
| Application: | 2,2,4-Trimethyl-1,3-penta |
| General description: | 2,2,4-Trimethyl-1,3-penta |
| Legal Information: | Manufactured by Eastman Chemical Company. Distributed by Aldrich Chemical Company. |
| Packaging: | 1, 4 L in glass bottle |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 1 |
| Flash Point(F) | 251.6 °F - closed cup |
| Flash Point(C) | 122 °C - closed cup |
| Purity | 99% |
| bp | 255 °C (lit.) |
| mp | −50 °C (lit.) |
| Density | 0.95 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352001 |

