2-Fluoro-4-methylbenzoyl chloride
TL;DR: 2-Fluoro-4-methylbenzoyl chloride (CAS 59189-98-9) is a chemical compound with molecular formula C8H6ClFO and molecular weight 172.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-4-methylbenzoyl chloride
Also Known As: 2-Fluoro-4-methylbenzoyl chloride, 2-fluoro-p-toluyl chloride, 2-fluoro-4-methyl-benzoyl Chloride, 2-fluoro-4-methylbenzoylchloride, Benzoyl chloride, 2-fluoro-4-methyl-
| Molecular Formula | C8H6ClFO |
|---|---|
| Molecular Weight | 172.01 g/mol |
| LogP | 2.51312 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.00912 |
| Heavy Atoms | 11 |
| Complexity | 296.1436 |
Chemical Identifiers
| CAS Number | 59189-98-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)Cl)F |
Product Overview
2-Fluoro-4-methylbenzoyl chloride (CAS 59189-98-9), with molecular formula C8H6ClFO and molecular weight 172.01 g/mol. IUPAC: 2-fluoro-4-methylbenzoyl chloride.
Chemical Property Profile of 2-Fluoro-4-methylbenzoyl chloride
Property Insights of 2-Fluoro-4-methylbenzoyl chloride
The XLogP value of 2.51312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-4-methylbenzoyl chloride. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Fluoro-4-methylbenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-4-methylbenzoyl chloride 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-Fluoro-4-methylbenzoyl chloride?
The CAS number of 2-Fluoro-4-methylbenzoyl chloride is 59189-98-9.
What is the molecular formula of 2-Fluoro-4-methylbenzoyl chloride?
The molecular formula of 2-Fluoro-4-methylbenzoyl chloride is C8H6ClFO.
What is the molecular weight of 2-Fluoro-4-methylbenzoyl chloride?
The molecular weight of 2-Fluoro-4-methylbenzoyl chloride is 172.01 g/mol.
Where can I buy 2-Fluoro-4-methylbenzoyl chloride?
You can request a quote for 2-Fluoro-4-methylbenzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-4-methylbenzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-4-methylbenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.