![2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane structure](/static/products/885/885460-66-2.png)
2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane
TL;DR: 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane (CAS 885460-66-2) is a chemical compound with molecular formula C13H17ClO2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]oxirane
Also Known As: 2-[4-chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane, 2-[(4-chloro-2-isopropyl-5-methylphenoxy)methyl]oxirane, 2-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}oxirane, 2-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]oxirane
| Molecular Formula | C13H17ClO2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 3.54942 |
| Topological Polar Surface Area | 21.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.0917 |
| Heavy Atoms | 16 |
| Complexity | 383.76413 |
Chemical Identifiers
| CAS Number | 885460-66-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCC2CO2 |
Product Overview
2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane (CAS 885460-66-2), with molecular formula C13H17ClO2 and molecular weight 240.09 g/mol. IUPAC: 2-[(4-chloro-5-methyl-2-propan-2-ylphenoxy)methyl]oxirane.
Chemical Property Profile of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane
Property Insights of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane
The XLogP value of 3.54942 indicates that 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.76 Ų, 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane 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 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane?
The CAS number of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane is 885460-66-2.
What is the molecular formula of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane?
The molecular formula of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane is C13H17ClO2.
What is the molecular weight of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane?
The molecular weight of 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane is 240.09 g/mol.
Where can I buy 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane?
You can request a quote for 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxymethyl]oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.