Trimethyl orthovalerate
ALDRICH/254517 - 97%
Synonym: 1,1,1-
CAS Number: 13820-09-2
Empirical Formula (Hill Notation): C8H18O3
Molecular Weight: 162.23
EC Number: 237-496-5
MDL Number: MFCD00008481
Linear Formula: CH3CH2CH2CH2C(OCH3)3
Product Type: Chemical
| assay | 97% |
| bp | 164-166 °C (lit.) |
| density | 0.941 g/mL at 25 °C (lit.) |
| functional group | ether |
| InChI | 1S/C8H18O3/c1-5-6-7-8(9-2 |
| InChI key | XUXVVQKJULMMKX-UHFFFAOYSA |
| Quality Level | 200 ![]() |
| refractive index | n |
| SMILES string | CCCCC(OC)(OC)OC |
| Application: | Trimethyl orthovalerate has been used in the preparation of: • various 9-O-acyl derivatives of N-acetyl- and N-glycoloyl-neuraminic acid • 2-methyl, 2-ethyl, 2-propyl and 2-butyl-3-benzimidazolyl- |
| General description: | Kinetics of unimolecular gas-phase elimination of trimethyl orthovalerate has been investigated. |
| Packaging: | 5 g in glass bottle |
| Symbol | ![]() GHS02,GHS07 |
| Signal word | Warning |
| Hazard statements | H226 - H315 - H319 |
| Precautionary statements | P210 - P302 + P352 - P305 + P351 + P338 |
| Hazard Codes | Xi |
| Risk Statements | 10-36/38 |
| Safety Statements | 26-36 |
| RIDADR | UN 3272 3 / PGIII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 107.6 °F - closed cup |
| Flash Point(C) | 42 °C - closed cup |
| Purity | 97% |
| bp | 164-166 °C (lit.) |
| Density | 0.941 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |



