2,2,4-Trimethyl-1,3-pentanediol
TL;DR: 2,2,4-Trimethyl-1,3-pentanediol (CAS 144-19-4) is a chemical compound with molecular formula C8H18O2 and molecular weight 146.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,4-trimethylpentane-1,3-diol
Also Known As: 2,2,4-TRIMETHYL-1,3-PENTANEDIOL, 2,2,4-Trimethylpentane-1,3-diol, TMPD, TMPD (alcohol), null
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18O2 |
| Molecular Weight | 146.13068 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.13068 Da |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
| Melting Point | 51-52 °C |
| Boiling Point | 234 °C @ 737 MM HG |
| Density | 0.937 AT 15 °C/15 °C |
| Flash Point | 113 °C |
| Vapor Pressure | 0.01 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.4513 @ 15 °C/D; SADTLER REFERENCE NUMBER: 6527 (IR, PRISM) |
| Solubility | SOL IN HOT BENZENE |
| SMILES | CC(C)C(C(C)(C)CO)O |
| InChIKey | JCTXKRPTIMZBJT-UHFFFAOYSA-N |
Product Description
Applications: 2,2,4-Trimethyl-1,3-pentanediol is used in polymer chemistry and functional materials synthesis, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2,2,4-Trimethyl-1,3-pentanediol is a polymer intermediate identified by CAS number 144-19-4 and the molecular formula C8H18O2 and a molecular weight of 146.13 g/mol. Physically, the compound has a density of 0.937 AT 15 °C/15 °C g/cm³, a solubility: SOL IN HOT BENZENE. Synonyms include 2,2,4-TRIMETHYL-1,3-PENTANEDIOL and 2,2,4-Trimethylpentane-1,3-diol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2,2,4-Trimethyl-1,3-pentanediol
Property Insights of 2,2,4-Trimethyl-1,3-pentanediol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,4-Trimethyl-1,3-pentanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 2,2,4-Trimethyl-1,3-pentanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-1,3-pentanediol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2,4-Trimethyl-1,3-pentanediol?
The CAS number of 2,2,4-Trimethyl-1,3-pentanediol is 144-19-4.
What is the molecular formula of 2,2,4-Trimethyl-1,3-pentanediol?
The molecular formula of 2,2,4-Trimethyl-1,3-pentanediol is C8H18O2.
What is the molecular weight of 2,2,4-Trimethyl-1,3-pentanediol?
The molecular weight of 2,2,4-Trimethyl-1,3-pentanediol is 146.13068 g/mol.
What are the applications of 2,2,4-Trimethyl-1,3-pentanediol?
2,2,4-Trimethyl-1,3-pentanediol is used in polymer chemistry and functional materials synthesis, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project...
Where can I buy 2,2,4-Trimethyl-1,3-pentanediol?
You can request a quote for 2,2,4-Trimethyl-1,3-pentanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2,4-Trimethyl-1,3-pentanediol?
Yes, CoreyChem provides custom synthesis services for 2,2,4-Trimethyl-1,3-pentanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.