![[(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate structure](/static/products/1200/120085-63-4.webp)
[(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate
TL;DR: [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate (CAS 120085-63-4) is a chemical compound with molecular formula C13H15NO7 and molecular weight 297.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate
Also Known As: [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate|J1.753.103D|4,5,7-TRI-O-ACETYL-2,6-ANHYDRO-3-DEOXY-D-LYXO-HEPT-2-ENONONITRILE|5-(Hydroxymethyl)-6-phenyl-4,5-dihydro-3(2H)-pyridazinone|1-Cyano-3-O,4-O,6-O-triacetyl-1,5-anhydro-2-deoxy-D-lyxo-hexa-1-enitol|2,3-PYRIDINEDICARBOXYLIC ACID,5-(TRIFLUOROMETHYL)-,DIETHYL ESTER|(2R,3R,4R)-2-[(Acetyloxy)methyl]-6-cyano-3,4-dihydro-2H-pyran-3,4-diyl diacetate|[(2R,3R,4R)-3,4-bis(acetyloxy)-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate|RefChem:388707|DTXCID80321508
| Molecular Formula | C13H15NO7 |
|---|---|
| Molecular Weight | 297.08 g/mol |
| LogP | 0.21918 |
| Topological Polar Surface Area | 111.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.08484 |
| Heavy Atoms | 21 |
| Complexity | 505.1394 |
Chemical Identifiers
| CAS Number | 120085-63-4 |
|---|---|
| SMILES | CC(=O)OC[C@@H]1[C@@H]([C@@H](C=C(O1)C#N)OC(=O)C)OC(=O)C |
Product Overview
[(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate (CAS 120085-63-4), with molecular formula C13H15NO7 and molecular weight 297.08 g/mol. IUPAC: [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate.
Chemical Property Profile of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate
Property Insights of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate
The XLogP value of 0.21918 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate. The TPSA of 111.92 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate. Following Lipinski's Rule of Five, [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate has 0 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 [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The CAS number of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate is 120085-63-4.
What is the molecular formula of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The molecular formula of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate is C13H15NO7.
What is the molecular weight of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
The molecular weight of [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate is 297.08 g/mol.
Where can I buy [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
You can request a quote for [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [(2R,3R,4R)-3,4-diacetyloxy-6-cyano-3,4-dihydro-2H-pyran-2-yl]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.