2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate
TL;DR: 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate (CAS 87335-77-1) is a chemical compound with molecular formula C12H16O7 and molecular weight 272.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate
Also Known As: 3,4,6-Tri-O-acetyl-D-galactal, Tri-O-acetyl-D-galactal, D-Galactal Triacetate, Triacetylgalactal, D- threeGalNAcene
| Molecular Formula | C12H16O7 |
|---|---|
| Molecular Weight | 272.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 272.0896 |
| Heavy Atoms | 19 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 87335-77-1 |
|---|---|
| SMILES | CC(=O)OC[C@@H]1[C@@H]([C@@H](C=CO1)OC(=O)C)OC(=O)C |
| InChIKey | LLPWGHLVUPBSLP-IJLUTSLNSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate (CAS 87335-77-1), with molecular formula C12H16O7 and molecular weight 272.09 g/mol. IUPAC: [(2R,3R,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate.
Chemical Property Profile of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate
Property Insights of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate. Following Lipinski's Rule of Five, 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate has 0 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 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate?
The CAS number of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate is 87335-77-1.
What is the molecular formula of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate?
The molecular formula of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate is C12H16O7.
What is the molecular weight of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate?
The molecular weight of 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate is 272.09 g/mol.
Where can I buy 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate?
You can request a quote for 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-anhydro-5-deoxy-D-arabino-hex-5-enitol triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.