2-Chloro-4-fluoro-3-methoxy-1-methylbenzene
TL;DR: 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene (CAS 261762-79-2) is a chemical compound with molecular formula C8H8ClFO and molecular weight 174.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-fluoro-2-methoxy-4-methylbenzene
Also Known As: 2-Chloro-6-fluoro-3-methylanisole, 2-chloro-4-fluoro-3-methoxy-1-methylbenzene, 3-chloro-1-fluoro-2-methoxy-4-methylbenzene, Benzene, 2-chloro-4-fluoro-3-methoxy-1-methyl-, 2-Chloro-4-fluoro-3-methoxytoluene
| Molecular Formula | C8H8ClFO |
|---|---|
| Molecular Weight | 174.02 g/mol |
| LogP | 2.79612 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.02477 |
| Heavy Atoms | 11 |
| Complexity | 273.03973 |
Chemical Identifiers
| CAS Number | 261762-79-2 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)F)OC)Cl |
Product Overview
2-Chloro-4-fluoro-3-methoxy-1-methylbenzene (CAS 261762-79-2), with molecular formula C8H8ClFO and molecular weight 174.02 g/mol. IUPAC: 3-chloro-1-fluoro-2-methoxy-4-methylbenzene.
Chemical Property Profile of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene
Property Insights of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene
The XLogP value of 2.79612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene. With a topological polar surface area (TPSA) of 9.23 Ų, 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene 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 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene?
The CAS number of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene is 261762-79-2.
What is the molecular formula of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene?
The molecular formula of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene is C8H8ClFO.
What is the molecular weight of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene?
The molecular weight of 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene is 174.02 g/mol.
Where can I buy 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene?
You can request a quote for 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-fluoro-3-methoxy-1-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.