1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene
TL;DR: 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene (CAS 711-45-5) is a chemical compound with molecular formula C10H12FNO2 and molecular weight 197.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-2,3,5,6-tetramethyl-4-nitrobenzene
Also Known As: 1-fluoro-2,3,5,6-tetramethyl-4-nitrobenzene, 1-fluoro-2,3,5,6-tetramethyl-4-nitro-benzene
| Molecular Formula | C10H12FNO2 |
|---|---|
| Molecular Weight | 197.09 g/mol |
| LogP | 2.96758 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.0852 |
| Heavy Atoms | 14 |
| Complexity | 384.0684 |
Chemical Identifiers
| CAS Number | 711-45-5 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)F)C |
Product Overview
1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene (CAS 711-45-5), with molecular formula C10H12FNO2 and molecular weight 197.09 g/mol. IUPAC: 1-fluoro-2,3,5,6-tetramethyl-4-nitrobenzene.
Chemical Property Profile of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene
Property Insights of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene
The XLogP value of 2.96758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene. With a topological polar surface area (TPSA) of 43.14 Ų, 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene 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 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene?
The CAS number of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene is 711-45-5.
What is the molecular formula of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene?
The molecular formula of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene is C10H12FNO2.
What is the molecular weight of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene?
The molecular weight of 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene is 197.09 g/mol.
Where can I buy 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene?
You can request a quote for 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-2,3,5,6-tetramethyl-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.