![[(4-Methoxybutoxy)methyl]benzene structure](/static/products/3160/31600-47-2.webp)
[(4-Methoxybutoxy)methyl]benzene
TL;DR: [(4-Methoxybutoxy)methyl]benzene (CAS 31600-47-2) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxybutoxymethylbenzene
Also Known As: [(4-Methoxybutoxy)methyl]benzene|1-phenyl-2,7-dioxaoctane|(4-Methoxybutoxy)methylbenzene|4-methoxybutoxymethylbenzene|((4-Methoxybutoxy)methyl)benzene|Benzene, [(4-methoxybutoxy)methyl]-|[(4-Methoxybutoxy)methyl]benzene #|RefChem:203582|ODRNXWXLMHZREW-UHFFFAOYSA-N
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 31600-47-2 |
|---|---|
| SMILES | COCCCCOCC1=CC=CC=C1 |
| InChIKey | ODRNXWXLMHZREW-UHFFFAOYSA-N |
Product Overview
[(4-Methoxybutoxy)methyl]benzene (CAS 31600-47-2), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 4-methoxybutoxymethylbenzene.
Chemical Property Profile of [(4-Methoxybutoxy)methyl]benzene
Property Insights of [(4-Methoxybutoxy)methyl]benzene
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(4-Methoxybutoxy)methyl]benzene. With a topological polar surface area (TPSA) of 18.5 Ų, [(4-Methoxybutoxy)methyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(4-Methoxybutoxy)methyl]benzene 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 [(4-Methoxybutoxy)methyl]benzene?
The CAS number of [(4-Methoxybutoxy)methyl]benzene is 31600-47-2.
What is the molecular formula of [(4-Methoxybutoxy)methyl]benzene?
The molecular formula of [(4-Methoxybutoxy)methyl]benzene is C12H18O2.
What is the molecular weight of [(4-Methoxybutoxy)methyl]benzene?
The molecular weight of [(4-Methoxybutoxy)methyl]benzene is 194.13 g/mol.
Where can I buy [(4-Methoxybutoxy)methyl]benzene?
You can request a quote for [(4-Methoxybutoxy)methyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4-Methoxybutoxy)methyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for [(4-Methoxybutoxy)methyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.