Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-
TL;DR: Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- (CAS 110875-85-9) is a chemical compound with molecular formula C21H28O and molecular weight 296.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylmethoxy-4-(2,4,4-trimethylpentan-2-yl)benzene
Also Known As: benzyl 4-tert-octylphenyl ether, Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-, 1-phenylmethoxy-4-(2,4,4-trimethylpentan-2-yl)benzene, 2,2,4-trimethyl-4-(4-phenylmethoxyphenyl)pentane, 1-(benzyloxy)-4-(1,1,3,3-tetramethylbutyl)benzene
| Molecular Formula | C21H28O |
|---|---|
| Molecular Weight | 296.21 g/mol |
| LogP | 5.9794 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.21402 |
| Heavy Atoms | 22 |
| Complexity | 573.55426 |
Chemical Identifiers
| CAS Number | 110875-85-9 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC2=CC=CC=C2 |
Product Overview
Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- (CAS 110875-85-9), with molecular formula C21H28O and molecular weight 296.21 g/mol. IUPAC: 1-phenylmethoxy-4-(2,4,4-trimethylpentan-2-yl)benzene.
Chemical Property Profile of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-
Property Insights of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-
The XLogP value of 5.9794 indicates that Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-?
The CAS number of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- is 110875-85-9.
What is the molecular formula of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-?
The molecular formula of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- is C21H28O.
What is the molecular weight of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-?
The molecular weight of Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- is 296.21 g/mol.
Where can I buy Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-?
You can request a quote for Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-(phenylmethoxy)-4-(1,1,3,3-tetramethylbutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.