1,1,1-Trimethoxypentane CAS#13820-09-2
Valuable Pharmaceutical Intermediate: Trimethyl orthovalerate is widely used in the synthesis of 1,2,4-triazolo[1,5-c]pyrimidine derivatives for human adenosine A3 receptor ligand research.
Versatile Synthetic Precursor: The compound serves as an important precursor for the preparation of N-sulfonyl and N-sulfinyl imines and imidates.
Suitable for Advanced Organic Synthesis: Its chemical properties make it highly applicable in pharmaceutical and fine chemical synthesis processes.
Broad Research Application Potential: Trimethyl orthovalerate is useful in medicinal chemistry and organic synthesis research involving bioactive compound development.
1,1,1-Trimethoxypentane Chemical Properties
| Boiling point | 164-166 °C (lit.) |
| density | 0.941 g/mL at 25 °C (lit.) |
| refractive index | 1.408-1.41 |
| Fp | 41 °C |
| storage temp. | Flammables area |
| solubility | Chloroform (Slightly), DMSO, Methanol (Slightly) |
| form | clear liquid |
| color | Colorless to Almost colorless |
| Sensitive | Moisture Sensitive |
| Merck | 149717 |
| BRN | 1739200 |
| Stability: | Unstable in acidic solution, Unstable In Acidic Solution |
| InChI | 1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3 |
| InChIKey | XUXVVQKJULMMKX-UHFFFAOYSA-N |
| SMILES | CCCCC(OC)(OC)OC |
| CAS DataBase Reference | 13820-09-2(CAS DataBase Reference) |
| NIST Chemistry Reference | Pentane, 1,1,1-trimethoxy-(13820-09-2) |
| EPA Substance Registry System | Pentane, 1,1,1-trimethoxy- (13820-09-2) |
Product Application of 1,1,1-Trimethoxypentane CAS#13820-09-2
Trimethyl orthovalerate has been utilized in the synthesis of various 9-O-acyl derivatives of N-acetylneuraminic acid and N-glycoloylneuraminic acid. It is also used in the preparation of 2-methyl, 2-ethyl, 2-propyl, and 2-butyl-3-benzimidazolyl-4(3H)-quinazolinone derivatives.
