1-Butoxybutyl acetate
TL;DR: 1-Butoxybutyl acetate (CAS 93920-46-8) is a chemical compound with molecular formula C10H20O3 and molecular weight 188.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butoxybutyl acetate
Also Known As: 1-butoxybutyl acetate, Essigsaeure-(1-butoxy-butylester), (+-)-(1-Butoxy-butyl)-acetat, 1-Butanol, 1-butoxy-,1-acetate
| Molecular Formula | C10H20O3 |
|---|---|
| Molecular Weight | 188.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 188.14125 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 93920-46-8 |
|---|---|
| SMILES | CCCCOC(CCC)OC(=O)C |
| InChIKey | UAIJLTSVXNMMEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butoxybutyl acetate (CAS 93920-46-8), with molecular formula C10H20O3 and molecular weight 188.14 g/mol. IUPAC: 1-butoxybutyl acetate.
Chemical Property Profile of 1-Butoxybutyl acetate
Property Insights of 1-Butoxybutyl acetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butoxybutyl acetate. With a topological polar surface area (TPSA) of 35.5 Ų, 1-Butoxybutyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butoxybutyl 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 1-Butoxybutyl acetate?
The CAS number of 1-Butoxybutyl acetate is 93920-46-8.
What is the molecular formula of 1-Butoxybutyl acetate?
The molecular formula of 1-Butoxybutyl acetate is C10H20O3.
What is the molecular weight of 1-Butoxybutyl acetate?
The molecular weight of 1-Butoxybutyl acetate is 188.14 g/mol.
Where can I buy 1-Butoxybutyl acetate?
You can request a quote for 1-Butoxybutyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butoxybutyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Butoxybutyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.