Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate
TL;DR: Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate (CAS 52373-72-5) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate
Also Known As: Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate, (S)-methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate, Methyl (R)-(+)-2,2-dimethyl-1,3-dioxolane-4-carboxylate, (R)-methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate, 1,3-Dioxolane-4-carboxylicacid,2,2-dimethyl-,methylester(9CI)
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 52373-72-5 |
|---|---|
| SMILES | CC1(OCC(O1)C(=O)OC)C |
| InChIKey | DOWWCCDWPKGNGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate (CAS 52373-72-5), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate.
Chemical Property Profile of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate
Property Insights of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate?
The CAS number of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate is 52373-72-5.
What is the molecular formula of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate?
The molecular formula of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate is C7H12O4.
What is the molecular weight of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate?
The molecular weight of Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate is 160.07 g/mol.
Where can I buy Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate?
You can request a quote for Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.