1-Chloro-3-fluoro-5-methylbenzene
TL;DR: 1-Chloro-3-fluoro-5-methylbenzene (CAS 93857-90-0) is a chemical compound with molecular formula C7H6ClF and molecular weight 144.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-fluoro-5-methylbenzene
Also Known As: 3-Chloro-5-fluorotoluene, 1-chloro-3-fluoro-5-methylbenzene, EINECS 299-224-1, 3-CHLORO-5-FLUORO TOLUENE, 5-CHLORO-3-FLUOROTOLUENE
| Molecular Formula | C7H6ClF |
|---|---|
| Molecular Weight | 144.01 g/mol |
| LogP | 2.78752 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.0142 |
| Heavy Atoms | 9 |
| Complexity | 169.67836 |
Chemical Identifiers
| CAS Number | 93857-90-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)Cl)F |
Product Overview
1-Chloro-3-fluoro-5-methylbenzene (CAS 93857-90-0), with molecular formula C7H6ClF and molecular weight 144.01 g/mol. IUPAC: 1-chloro-3-fluoro-5-methylbenzene.
Chemical Property Profile of 1-Chloro-3-fluoro-5-methylbenzene
Property Insights of 1-Chloro-3-fluoro-5-methylbenzene
The XLogP value of 2.78752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-3-fluoro-5-methylbenzene. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-3-fluoro-5-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3-fluoro-5-methylbenzene has 0 hydrogen bond donor(s) and 0 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-Chloro-3-fluoro-5-methylbenzene?
The CAS number of 1-Chloro-3-fluoro-5-methylbenzene is 93857-90-0.
What is the molecular formula of 1-Chloro-3-fluoro-5-methylbenzene?
The molecular formula of 1-Chloro-3-fluoro-5-methylbenzene is C7H6ClF.
What is the molecular weight of 1-Chloro-3-fluoro-5-methylbenzene?
The molecular weight of 1-Chloro-3-fluoro-5-methylbenzene is 144.01 g/mol.
Where can I buy 1-Chloro-3-fluoro-5-methylbenzene?
You can request a quote for 1-Chloro-3-fluoro-5-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-3-fluoro-5-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3-fluoro-5-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.