(3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate
TL;DR: (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate (CAS 6965-74-8) is a chemical compound with molecular formula C14H19NO8 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,5-triacetyloxy-5-cyanopentan-2-yl) acetate
Also Known As: TETRAACETYL-L-RHAMNONITRILE, (3,4,5-triacetyloxy-5-cyanopentan-2-yl) acetate, L-(-)-Fucose, aldononitrile, tetraacetate, 1-Cyanopentane-1,2,3,4-tetrayl tetraacetate, 1-cyanopentane-1,2,3,4-tetrayl tetraacetate(non-preferred name)
| Molecular Formula | C14H19NO8 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 329.11105 |
| Heavy Atoms | 23 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 6965-74-8 |
|---|---|
| SMILES | CC(C(C(C(C#N)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | MMUJVSPMJDQIMU-UHFFFAOYSA-N |
Product Overview
(3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate (CAS 6965-74-8), with molecular formula C14H19NO8 and molecular weight 329.11 g/mol. IUPAC: (3,4,5-triacetyloxy-5-cyanopentan-2-yl) acetate.
Chemical Property Profile of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate
Property Insights of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate. Following Lipinski's Rule of Five, (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate has 0 hydrogen bond donor(s) and 9 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 (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate?
The CAS number of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate is 6965-74-8.
What is the molecular formula of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate?
The molecular formula of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate is C14H19NO8.
What is the molecular weight of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate?
The molecular weight of (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate is 329.11 g/mol.
Where can I buy (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate?
You can request a quote for (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (3,4,5-Triacetyloxy-5-cyanopentan-2-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.