2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid
TL;DR: 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid (CAS 127062-02-6) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,5-trimethyl-1,3-dioxolane-4-carboxylic acid
Also Known As: 2,2,5-trimethyl-1,3-dioxolane-4-carboxylic acid, 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylato, (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylic acid, 1,3-Dioxolane-4-carboxylicacid,2,2,5-trimethyl-,(4R-trans)-(9CI), 1,3-Dioxolane-4-carboxylicacid,2,2,5-trimethyl-,cis-(9CI)
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H12O4 |
| Molecular Weight | 160.07356 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.07356 Da |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
| SMILES | CC1C(OC(O1)(C)C)C(=O)O |
| InChIKey | HNLGBHQJNORDKW-UHFFFAOYSA-N |
Chemical Property Profile of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid
Property Insights of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid?
The CAS number of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid is 127062-02-6.
What is the molecular formula of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid?
The molecular formula of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid is C7H12O4.
What is the molecular weight of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid?
The molecular weight of 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid is 160.07356 g/mol.
Where can I buy 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid?
You can request a quote for 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2,2,5-Trimethyl-1,3-dioxolane-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.