(1-Ethoxy-1-methylethyl)benzene
TL;DR: (1-Ethoxy-1-methylethyl)benzene (CAS 1712-74-9) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxypropan-2-ylbenzene
Also Known As: Cumyl ethyl ether, Pglcua, ethyl cumyl ether, (2-ethoxypropan-2-yl)benzene, Palmitoyl glucuronide
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 1712-74-9 |
|---|---|
| SMILES | CCOC(C)(C)C1=CC=CC=C1 |
| InChIKey | JNPNJMJXGPZCNE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1-Ethoxy-1-methylethyl)benzene (CAS 1712-74-9), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 2-ethoxypropan-2-ylbenzene.
Chemical Property Profile of (1-Ethoxy-1-methylethyl)benzene
Property Insights of (1-Ethoxy-1-methylethyl)benzene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Ethoxy-1-methylethyl)benzene. With a topological polar surface area (TPSA) of 9.2 Ų, (1-Ethoxy-1-methylethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Ethoxy-1-methylethyl)benzene 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 (1-Ethoxy-1-methylethyl)benzene?
The CAS number of (1-Ethoxy-1-methylethyl)benzene is 1712-74-9.
What is the molecular formula of (1-Ethoxy-1-methylethyl)benzene?
The molecular formula of (1-Ethoxy-1-methylethyl)benzene is C11H16O.
What is the molecular weight of (1-Ethoxy-1-methylethyl)benzene?
The molecular weight of (1-Ethoxy-1-methylethyl)benzene is 164.12 g/mol.
Where can I buy (1-Ethoxy-1-methylethyl)benzene?
You can request a quote for (1-Ethoxy-1-methylethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Ethoxy-1-methylethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (1-Ethoxy-1-methylethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.