4-Butoxy-2-methylpentan-2-YL acetate
TL;DR: 4-Butoxy-2-methylpentan-2-YL acetate (CAS 300700-93-0) is a chemical compound with molecular formula C12H24O3 and molecular weight 216.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butoxy-2-methylpentan-2-yl) acetate
Also Known As: (4-butoxy-2-methylpentan-2-yl) acetate, 4-BUTOXY-2-METHYLPENTAN-2-YL ACETATE
| Molecular Formula | C12H24O3 |
|---|---|
| Molecular Weight | 216.17 g/mol |
| LogP | 2.9234 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 216.17255 |
| Heavy Atoms | 15 |
| Complexity | 187.30626 |
Chemical Identifiers
| CAS Number | 300700-93-0 |
|---|---|
| SMILES | CCCCOC(C)CC(C)(C)OC(=O)C |
Product Overview
4-Butoxy-2-methylpentan-2-YL acetate (CAS 300700-93-0), with molecular formula C12H24O3 and molecular weight 216.17 g/mol. IUPAC: (4-butoxy-2-methylpentan-2-yl) acetate.
Chemical Property Profile of 4-Butoxy-2-methylpentan-2-YL acetate
Property Insights of 4-Butoxy-2-methylpentan-2-YL acetate
The XLogP value of 2.9234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Butoxy-2-methylpentan-2-YL acetate. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Butoxy-2-methylpentan-2-YL acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Butoxy-2-methylpentan-2-YL acetate has 0 hydrogen bond donor(s) and 3 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 4-Butoxy-2-methylpentan-2-YL acetate?
The CAS number of 4-Butoxy-2-methylpentan-2-YL acetate is 300700-93-0.
What is the molecular formula of 4-Butoxy-2-methylpentan-2-YL acetate?
The molecular formula of 4-Butoxy-2-methylpentan-2-YL acetate is C12H24O3.
What is the molecular weight of 4-Butoxy-2-methylpentan-2-YL acetate?
The molecular weight of 4-Butoxy-2-methylpentan-2-YL acetate is 216.17 g/mol.
Where can I buy 4-Butoxy-2-methylpentan-2-YL acetate?
You can request a quote for 4-Butoxy-2-methylpentan-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 4-Butoxy-2-methylpentan-2-YL acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Butoxy-2-methylpentan-2-YL acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.