![Butane, 1-[(2-methyl-2-propenyl)oxy]- structure](/static/products/539/53907-74-7.png)
Butane, 1-[(2-methyl-2-propenyl)oxy]-
TL;DR: Butane, 1-[(2-methyl-2-propenyl)oxy]- (CAS 53907-74-7) is a chemical compound with molecular formula C8H16O and molecular weight 128.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylprop-2-enoxy)butane
Also Known As: 2-Methylallyl(butyl) ether, 3-Butoxy-2-methyl-1-propene, 1-((2-methylallyl)oxy)butane, 1-(2-methylprop-2-enoxy)butane, 3-Butoxy-2-methyl-1-propene #
| Molecular Formula | C8H16O |
|---|---|
| Molecular Weight | 128.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 128.12012 |
| Heavy Atoms | 9 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 53907-74-7 |
|---|---|
| SMILES | CCCCOCC(=C)C |
| InChIKey | PCUWKMVRPVLRAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1-[(2-methyl-2-propenyl)oxy]- (CAS 53907-74-7), with molecular formula C8H16O and molecular weight 128.12 g/mol. IUPAC: 1-(2-methylprop-2-enoxy)butane.
Chemical Property Profile of Butane, 1-[(2-methyl-2-propenyl)oxy]-
Property Insights of Butane, 1-[(2-methyl-2-propenyl)oxy]-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-[(2-methyl-2-propenyl)oxy]-. With a topological polar surface area (TPSA) of 9.2 Ų, Butane, 1-[(2-methyl-2-propenyl)oxy]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-[(2-methyl-2-propenyl)oxy]- 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-[(2-methyl-2-propenyl)oxy]-?
The CAS number of Butane, 1-[(2-methyl-2-propenyl)oxy]- is 53907-74-7.
What is the molecular formula of Butane, 1-[(2-methyl-2-propenyl)oxy]-?
The molecular formula of Butane, 1-[(2-methyl-2-propenyl)oxy]- is C8H16O.
What is the molecular weight of Butane, 1-[(2-methyl-2-propenyl)oxy]-?
The molecular weight of Butane, 1-[(2-methyl-2-propenyl)oxy]- is 128.12 g/mol.
Where can I buy Butane, 1-[(2-methyl-2-propenyl)oxy]-?
You can request a quote for Butane, 1-[(2-methyl-2-propenyl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-[(2-methyl-2-propenyl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-[(2-methyl-2-propenyl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.