2,4-Diacetoxypentane
TL;DR: 2,4-Diacetoxypentane (CAS 7371-86-0) is a chemical compound with molecular formula C9H16O4 and molecular weight 188.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetyloxypentan-2-yl acetate
Also Known As: 2,4-Diacetoxypentane, 4-acetyloxypentan-2-yl acetate, pentane 2,4-diol diacetate, pentane-2,4-diyl diacetate, Diacetic acid 2,4-pentanediyl
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 7371-86-0 |
|---|---|
| SMILES | CC(CC(C)OC(=O)C)OC(=O)C |
| InChIKey | CUSIRZGMYUQIBF-UHFFFAOYSA-N |
Product Overview
2,4-Diacetoxypentane (CAS 7371-86-0), with molecular formula C9H16O4 and molecular weight 188.10 g/mol. IUPAC: 4-acetyloxypentan-2-yl acetate.
Chemical Property Profile of 2,4-Diacetoxypentane
Property Insights of 2,4-Diacetoxypentane
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diacetoxypentane. With a topological polar surface area (TPSA) of 52.6 Ų, 2,4-Diacetoxypentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Diacetoxypentane has 0 hydrogen bond donor(s) and 4 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 2,4-Diacetoxypentane?
The CAS number of 2,4-Diacetoxypentane is 7371-86-0.
What is the molecular formula of 2,4-Diacetoxypentane?
The molecular formula of 2,4-Diacetoxypentane is C9H16O4.
What is the molecular weight of 2,4-Diacetoxypentane?
The molecular weight of 2,4-Diacetoxypentane is 188.10 g/mol.
Where can I buy 2,4-Diacetoxypentane?
You can request a quote for 2,4-Diacetoxypentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diacetoxypentane?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diacetoxypentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.