Butane, 1,1-dimethoxy-
TL;DR: Butane, 1,1-dimethoxy- (CAS 4461-87-4) is a chemical compound with molecular formula C6H14O2 and molecular weight 118.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethoxybutane
Also Known As: 1,1-Dimethoxybutane, Butane, dimethoxy-, Butane, 1,1-dimethoxy-, Butane,dimethoxy-, Butanal dimethyl acetal
| Molecular Formula | C6H14O2 |
|---|---|
| Molecular Weight | 118.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 118.09938 |
| Heavy Atoms | 8 |
| Complexity | 41.0 |
Chemical Identifiers
| CAS Number | 4461-87-4 |
|---|---|
| SMILES | CCCC(OC)OC |
| InChIKey | DZKUKLGGGNLHNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1,1-dimethoxy- (CAS 4461-87-4), with molecular formula C6H14O2 and molecular weight 118.10 g/mol. IUPAC: 1,1-dimethoxybutane.
Chemical Property Profile of Butane, 1,1-dimethoxy-
Property Insights of Butane, 1,1-dimethoxy-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1,1-dimethoxy-. With a topological polar surface area (TPSA) of 18.5 Ų, Butane, 1,1-dimethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1,1-dimethoxy- has 0 hydrogen bond donor(s) and 2 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, 1,1-dimethoxy-?
The CAS number of Butane, 1,1-dimethoxy- is 4461-87-4.
What is the molecular formula of Butane, 1,1-dimethoxy-?
The molecular formula of Butane, 1,1-dimethoxy- is C6H14O2.
What is the molecular weight of Butane, 1,1-dimethoxy-?
The molecular weight of Butane, 1,1-dimethoxy- is 118.10 g/mol.
Where can I buy Butane, 1,1-dimethoxy-?
You can request a quote for Butane, 1,1-dimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1,1-dimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1,1-dimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.