alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol
TL;DR: alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol (CAS 53847-41-9) is a chemical compound with molecular formula C13H20O2 and molecular weight 208.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-2-methylpentan-3-ol
Also Known As: 3-(2-methoxyphenyl)-2-methylpentan-3-ol, 3-(2-Methoxyphenyl)-2-methyl-3-pentanol, 3-(2-Methoxyphenyl)-2-methyl-3-pentanol #, alpha-Ethyl-alpha-isopropyl-o-methoxybenzyl alcohol, alpha-Ethyl-alpha-isopropyl-2-methoxybenzenemethanol
| Molecular Formula | C13H20O2 |
|---|---|
| Molecular Weight | 208.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.14633 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 53847-41-9 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1OC)(C(C)C)O |
| InChIKey | CKTAGTCQWFFZAU-UHFFFAOYSA-N |
Product Overview
alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol (CAS 53847-41-9), with molecular formula C13H20O2 and molecular weight 208.15 g/mol. IUPAC: 3-(2-methoxyphenyl)-2-methylpentan-3-ol.
Chemical Property Profile of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol
Property Insights of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol
The XLogP value of 3.1 indicates that alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol has 1 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 alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol?
The CAS number of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol is 53847-41-9.
What is the molecular formula of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol?
The molecular formula of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol is C13H20O2.
What is the molecular weight of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol?
The molecular weight of alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol is 208.15 g/mol.
Where can I buy alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol?
You can request a quote for alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Ethyl-2-methoxy-alpha-(1-methylethyl)benzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.