3-Methoxy-3-methylbutyl acetate
TL;DR: 3-Methoxy-3-methylbutyl acetate (CAS 103429-90-9) is a chemical compound with molecular formula C8H16O3 and molecular weight 160.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methoxy-3-methylbutyl) acetate
Also Known As: 3-Methoxy-3-methylbutyl Acetate, 3-Methyl-3-methoxybutyl acetate, (3-methoxy-3-methylbutyl) acetate, 1-Butanol, 3-methoxy-3-methyl-, acetate, Acetic Acid 3-Methoxy-3-methylbutyl Ester
| Molecular Formula | C8H16O3 |
|---|---|
| Molecular Weight | 160.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 160.10994 |
| Heavy Atoms | 11 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 103429-90-9 |
|---|---|
| SMILES | CC(=O)OCCC(C)(C)OC |
| InChIKey | RYNQKSJRFHJZTK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxy-3-methylbutyl acetate (CAS 103429-90-9), with molecular formula C8H16O3 and molecular weight 160.11 g/mol. IUPAC: (3-methoxy-3-methylbutyl) acetate.
Chemical Property Profile of 3-Methoxy-3-methylbutyl acetate
Property Insights of 3-Methoxy-3-methylbutyl acetate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-3-methylbutyl acetate. With a topological polar surface area (TPSA) of 35.5 Ų, 3-Methoxy-3-methylbutyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-3-methylbutyl 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 3-Methoxy-3-methylbutyl acetate?
The CAS number of 3-Methoxy-3-methylbutyl acetate is 103429-90-9.
What is the molecular formula of 3-Methoxy-3-methylbutyl acetate?
The molecular formula of 3-Methoxy-3-methylbutyl acetate is C8H16O3.
What is the molecular weight of 3-Methoxy-3-methylbutyl acetate?
The molecular weight of 3-Methoxy-3-methylbutyl acetate is 160.11 g/mol.
Where can I buy 3-Methoxy-3-methylbutyl acetate?
You can request a quote for 3-Methoxy-3-methylbutyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-3-methylbutyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-3-methylbutyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.