2-Fluoro-4,5-dimethoxyaniline
TL;DR: 2-Fluoro-4,5-dimethoxyaniline (CAS 397-75-1) is a chemical compound with molecular formula C8H10FNO2 and molecular weight 171.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-4,5-dimethoxyaniline
Also Known As: 2-Fluoro-4,5-dimethoxyaniline, 4-Fluoro-5-amino veratrole, 4,5-Dimethoxy-2-fluoroaniline, 2-fluoro-4,5-dimethoxy-aniline, 2-Fluoro-4,5-dimethoxyaniline #
| Molecular Formula | C8H10FNO2 |
|---|---|
| Molecular Weight | 171.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.06955 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 397-75-1 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)N)F)OC |
| InChIKey | LDYNLRCFVQFFNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Fluoro-4,5-dimethoxyaniline (CAS 397-75-1), with molecular formula C8H10FNO2 and molecular weight 171.07 g/mol. IUPAC: 2-fluoro-4,5-dimethoxyaniline.
Chemical Property Profile of 2-Fluoro-4,5-dimethoxyaniline
Property Insights of 2-Fluoro-4,5-dimethoxyaniline
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-4,5-dimethoxyaniline. With a topological polar surface area (TPSA) of 44.5 Ų, 2-Fluoro-4,5-dimethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-4,5-dimethoxyaniline has 1 hydrogen bond donor(s) and 4 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-4,5-dimethoxyaniline?
The CAS number of 2-Fluoro-4,5-dimethoxyaniline is 397-75-1.
What is the molecular formula of 2-Fluoro-4,5-dimethoxyaniline?
The molecular formula of 2-Fluoro-4,5-dimethoxyaniline is C8H10FNO2.
What is the molecular weight of 2-Fluoro-4,5-dimethoxyaniline?
The molecular weight of 2-Fluoro-4,5-dimethoxyaniline is 171.07 g/mol.
Where can I buy 2-Fluoro-4,5-dimethoxyaniline?
You can request a quote for 2-Fluoro-4,5-dimethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-4,5-dimethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-4,5-dimethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.