2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside
TL;DR: 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside (CAS 54835-71-1) is a chemical compound with molecular formula C12H18O8 and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-2-methyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydropyran-6-one
Also Known As: 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside, (2S,3R)-2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl beta-D-glucopyranoside, (5R)-5,6-Dihydro-5beta-(beta-D-glucopyranosyloxy)-6alpha-methyl-2H-pyran-2-one, (5R,6S)-5-(beta-D-Glucopyranosyloxy)-6-methyl-5,6-dihydro-2H-pyran-2-one, 6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6-dihydropyran-2-one
| Molecular Formula | C12H18O8 |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.10016 |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 54835-71-1 |
|---|---|
| SMILES | C[C@H]1[C@@H](C=CC(=O)O1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
| InChIKey | KZOPXYPPFZYEHT-RKPZXMFYSA-N |
Product Overview
2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside (CAS 54835-71-1), with molecular formula C12H18O8 and molecular weight 290.10 g/mol. IUPAC: (2S,3R)-2-methyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydropyran-6-one.
Chemical Property Profile of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside
Property Insights of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside
The XLogP value of -1.6 indicates that 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside. Following Lipinski's Rule of Five, 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside has 4 hydrogen bond donor(s) and 8 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 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside?
The CAS number of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside is 54835-71-1.
What is the molecular formula of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside?
The molecular formula of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside is C12H18O8.
What is the molecular weight of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside?
The molecular weight of 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside is 290.10 g/mol.
Where can I buy 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside?
You can request a quote for 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-6-oxo-3,6-dihydro-2H-pyran-3-yl hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.