Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose
TL;DR: Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose (CAS 6752-49-4) is a chemical compound with molecular formula C14H16O5 and molecular weight 264.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-2-phenyl-4a,6,7,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-8-one
Also Known As: Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose, 6-methoxy-2-phenyl-4a,6,7,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-8-one, 9-methoxy-4-phenyl-3,5,10-trioxabicyclo[4.4.0]decan-7-one, RefChem:357286
| Molecular Formula | C14H16O5 |
|---|---|
| Molecular Weight | 264.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.09976 |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 6752-49-4 |
|---|---|
| SMILES | COC1CC(=O)C2C(O1)COC(O2)C3=CC=CC=C3 |
| InChIKey | UUNOJMADDVNEMA-UHFFFAOYSA-N |
Product Overview
Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose (CAS 6752-49-4), with molecular formula C14H16O5 and molecular weight 264.10 g/mol. IUPAC: 6-methoxy-2-phenyl-4a,6,7,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-8-one.
Chemical Property Profile of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose
Property Insights of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose. With a topological polar surface area (TPSA) of 54.0 Ų, Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose has 0 hydrogen bond donor(s) and 5 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 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose?
The CAS number of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose is 6752-49-4.
What is the molecular formula of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose?
The molecular formula of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose is C14H16O5.
What is the molecular weight of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose?
The molecular weight of Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose is 264.10 g/mol.
Where can I buy Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose?
You can request a quote for Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4,6-O-benzylidene-2-deoxyhexopyranosid-3-ulose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.