2-fluoro-N-methoxycarbonylaniline
TL;DR: 2-fluoro-N-methoxycarbonylaniline (CAS 16664-12-3) is a chemical compound with molecular formula C8H8FNO2 and molecular weight 169.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(2-fluorophenyl)carbamate
Also Known As: Methyl N-(2-fluorophenyl)carbamate, methyl (2-fluorophenyl)carbamate, 2-fluoro-N-methoxycarbonylaniline, 2-Fluorophenylcarbamic acid methyl, N-(2-fluorophenyl)methoxycarboxamide
| Molecular Formula | C8H8FNO2 |
|---|---|
| Molecular Weight | 169.05 g/mol |
| LogP | 2.004 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.05391 |
| Heavy Atoms | 12 |
| Complexity | 288.14127 |
Chemical Identifiers
| CAS Number | 16664-12-3 |
|---|---|
| SMILES | COC(=O)NC1=CC=CC=C1F |
Product Overview
2-fluoro-N-methoxycarbonylaniline (CAS 16664-12-3), with molecular formula C8H8FNO2 and molecular weight 169.05 g/mol. IUPAC: methyl N-(2-fluorophenyl)carbamate.
Chemical Property Profile of 2-fluoro-N-methoxycarbonylaniline
Property Insights of 2-fluoro-N-methoxycarbonylaniline
The XLogP value of 2.004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-fluoro-N-methoxycarbonylaniline. With a topological polar surface area (TPSA) of 38.33 Ų, 2-fluoro-N-methoxycarbonylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-fluoro-N-methoxycarbonylaniline has 1 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 2-fluoro-N-methoxycarbonylaniline?
The CAS number of 2-fluoro-N-methoxycarbonylaniline is 16664-12-3.
What is the molecular formula of 2-fluoro-N-methoxycarbonylaniline?
The molecular formula of 2-fluoro-N-methoxycarbonylaniline is C8H8FNO2.
What is the molecular weight of 2-fluoro-N-methoxycarbonylaniline?
The molecular weight of 2-fluoro-N-methoxycarbonylaniline is 169.05 g/mol.
Where can I buy 2-fluoro-N-methoxycarbonylaniline?
You can request a quote for 2-fluoro-N-methoxycarbonylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-fluoro-N-methoxycarbonylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-fluoro-N-methoxycarbonylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.