Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside
TL;DR: Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside (CAS 13440-33-0) is a chemical compound with molecular formula C14H18O7S and molecular weight 330.07733 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8-hydroxy-3-methoxy-2,6-dioxabicyclo[3.2.1]octan-4-yl) 4-methylbenzenesulfonate
Also Known As: methyl 3,6-anhydro-2-o-[(4-methylphenyl)sulfonyl]hexopyranoside, Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside, (8-hydroxy-3-methoxy-2,6-dioxabicyclo[3.2.1]octan-4-yl) 4-methylbenzenesulfonate
Technical Specifications
| Molecular Formula | C14H18O7S |
| Molecular Weight | 330.07733 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 99.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.07733 Da |
| Heavy Atoms | 22 |
| Complexity | 480.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2C3C(C(CO3)OC2OC)O |
| InChIKey | SNGVHYGCQOEARP-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside
Property Insights of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside. Following Lipinski's Rule of Five, Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside 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
What is the CAS number of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside?
The CAS number of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside is 13440-33-0.
What is the molecular formula of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside?
The molecular formula of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside is C14H18O7S.
What is the molecular weight of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside?
The molecular weight of Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside is 330.07733 g/mol.
Where can I buy Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside?
You can request a quote for Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside?
Yes, CoreyChem provides custom synthesis services for Methyl 3,6-anhydro-2-O-(4-methylbenzene-1-sulfonyl)hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.