4,6-O-Benzylidene-D-glucal
TL;DR: 4,6-O-Benzylidene-D-glucal (CAS 63598-36-7) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR,8R,8aS)-2-phenyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-ol
Also Known As: 4,6-O-Benzylidene-D-glucal, 4-O,6-O-Benzylidene-D-glucal, 4,6-O-(R)-Benzylidene-D-glucal, (4aR,8R,8aS)-2-phenyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-ol, J1.799.543J
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 1.374 |
| Topological Polar Surface Area | 47.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 403.14032 |
Chemical Identifiers
| CAS Number | 63598-36-7 |
|---|---|
| SMILES | C1[C@@H]2[C@H]([C@@H](C=CO2)O)OC(O1)C3=CC=CC=C3 |
Product Overview
4,6-O-Benzylidene-D-glucal (CAS 63598-36-7), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: (4aR,8R,8aS)-2-phenyl-4,4a,8,8a-tetrahydropyrano[3,2-d][1,3]dioxin-8-ol.
Chemical Property Profile of 4,6-O-Benzylidene-D-glucal
Property Insights of 4,6-O-Benzylidene-D-glucal
The XLogP value of 1.374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-O-Benzylidene-D-glucal. With a topological polar surface area (TPSA) of 47.92 Ų, 4,6-O-Benzylidene-D-glucal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-O-Benzylidene-D-glucal 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
Frequently Asked Questions
What is the CAS number of 4,6-O-Benzylidene-D-glucal?
The CAS number of 4,6-O-Benzylidene-D-glucal is 63598-36-7.
What is the molecular formula of 4,6-O-Benzylidene-D-glucal?
The molecular formula of 4,6-O-Benzylidene-D-glucal is C13H14O4.
What is the molecular weight of 4,6-O-Benzylidene-D-glucal?
The molecular weight of 4,6-O-Benzylidene-D-glucal is 234.09 g/mol.
Where can I buy 4,6-O-Benzylidene-D-glucal?
You can request a quote for 4,6-O-Benzylidene-D-glucal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-O-Benzylidene-D-glucal?
Yes, KEHONG BIO provides custom synthesis services for 4,6-O-Benzylidene-D-glucal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.