1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene
TL;DR: 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene (CAS 98517-86-3) is a chemical compound with molecular formula C19H32O2 and molecular weight 292.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(8-methoxy-3,7-dimethyloctoxy)methyl]-4-methylbenzene
Also Known As: 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene, 1-[(8-methoxy-3,7-dimethyloctoxy)methyl]-4-methylbenzene, 1-methoxy-2,6-dimethyl-8-[(4-methylphenyl)methoxy]octane, 1-{[(8-methoxy-3,7-dimethyloctyl)oxy]methyl}-4-methylbenzene
| Molecular Formula | C19H32O2 |
|---|---|
| Molecular Weight | 292.24 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 292.24023 |
| Heavy Atoms | 21 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 98517-86-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)COCCC(C)CCCC(C)COC |
| InChIKey | IUUZSOGISBGBQS-UHFFFAOYSA-N |
Product Overview
1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene (CAS 98517-86-3), with molecular formula C19H32O2 and molecular weight 292.24 g/mol. IUPAC: 1-[(8-methoxy-3,7-dimethyloctoxy)methyl]-4-methylbenzene.
Chemical Property Profile of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene
Property Insights of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene
The XLogP value of 5.2 indicates that 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene?
The CAS number of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene is 98517-86-3.
What is the molecular formula of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene?
The molecular formula of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene is C19H32O2.
What is the molecular weight of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene?
The molecular weight of 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene is 292.24 g/mol.
Where can I buy 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene?
You can request a quote for 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-((8-Methoxy-3,7-dimethyloctoxy)methyl)-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.