Butane, 1-methoxy-3-methyl-
TL;DR: Butane, 1-methoxy-3-methyl- (CAS 626-91-5) is a chemical compound with molecular formula CC(C)CCOC and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-3-methylbutane
Also Known As: 1-Methoxy-3-methylbutane, Butane, 1-methoxy-3-methyl-, METHYL ISOAMYL ETHER, Ether, isopentyl methyl, methylisoamyl ether
| Molecular Formula | CC(C)CCOC |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 33.0 |
Chemical Identifiers
| CAS Number | 626-91-5 |
|---|---|
| SMILES | CC(C)CCOC |
| InChIKey | ZQAYBCWERYRAMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1-methoxy-3-methyl- (CAS 626-91-5), with molecular formula CC(C)CCOC and molecular weight 102.10 g/mol. IUPAC: 1-methoxy-3-methylbutane.
Chemical Property Profile of Butane, 1-methoxy-3-methyl-
Property Insights of Butane, 1-methoxy-3-methyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-methoxy-3-methyl-. With a topological polar surface area (TPSA) of 9.2 Ų, Butane, 1-methoxy-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-methoxy-3-methyl- has 0 hydrogen bond donor(s) and 1 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 Butane, 1-methoxy-3-methyl-?
The CAS number of Butane, 1-methoxy-3-methyl- is 626-91-5.
What is the molecular formula of Butane, 1-methoxy-3-methyl-?
The molecular formula of Butane, 1-methoxy-3-methyl- is CC(C)CCOC.
What is the molecular weight of Butane, 1-methoxy-3-methyl-?
The molecular weight of Butane, 1-methoxy-3-methyl- is 102.10 g/mol.
Where can I buy Butane, 1-methoxy-3-methyl-?
You can request a quote for Butane, 1-methoxy-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-methoxy-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-methoxy-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.