Methyl 2,4:3,5-di-O-methylene-D-gluconate
TL;DR: Methyl 2,4:3,5-di-O-methylene-D-gluconate (CAS 27934-92-5) is a chemical compound with molecular formula C9H14O7 and molecular weight 234.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-(hydroxymethyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine-4-carboxylate
Also Known As: Methyl 2,4:3,5-di-O-methylene-D-gluconate, 2,4:3,5-Di-O-methylene-D-gluconic Acid Methyl Ester, methyl 8-(hydroxymethyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine-4-carboxylate, Methyl 8-(hydroxymethyl)tetrahydro-2H,6H-[1,3]dioxino[5,4-d][1,3]dioxine-4-carboxylate
| Molecular Formula | C9H14O7 |
|---|---|
| Molecular Weight | 234.07 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.07396 |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 27934-92-5 |
|---|---|
| SMILES | COC(=O)C1C2C(C(OCO2)CO)OCO1 |
| InChIKey | KKDYZKUSFKSGCK-UHFFFAOYSA-N |
Product Overview
Methyl 2,4:3,5-di-O-methylene-D-gluconate (CAS 27934-92-5), with molecular formula C9H14O7 and molecular weight 234.07 g/mol. IUPAC: methyl 8-(hydroxymethyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine-4-carboxylate.
Chemical Property Profile of Methyl 2,4:3,5-di-O-methylene-D-gluconate
Property Insights of Methyl 2,4:3,5-di-O-methylene-D-gluconate
The XLogP value of -1.2 indicates that Methyl 2,4:3,5-di-O-methylene-D-gluconate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,4:3,5-di-O-methylene-D-gluconate. Following Lipinski's Rule of Five, Methyl 2,4:3,5-di-O-methylene-D-gluconate has 1 hydrogen bond donor(s) and 7 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 2,4:3,5-di-O-methylene-D-gluconate?
The CAS number of Methyl 2,4:3,5-di-O-methylene-D-gluconate is 27934-92-5.
What is the molecular formula of Methyl 2,4:3,5-di-O-methylene-D-gluconate?
The molecular formula of Methyl 2,4:3,5-di-O-methylene-D-gluconate is C9H14O7.
What is the molecular weight of Methyl 2,4:3,5-di-O-methylene-D-gluconate?
The molecular weight of Methyl 2,4:3,5-di-O-methylene-D-gluconate is 234.07 g/mol.
Where can I buy Methyl 2,4:3,5-di-O-methylene-D-gluconate?
You can request a quote for Methyl 2,4:3,5-di-O-methylene-D-gluconate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,4:3,5-di-O-methylene-D-gluconate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,4:3,5-di-O-methylene-D-gluconate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.