4-Fluorophenyl methylcarbamate
TL;DR: 4-Fluorophenyl methylcarbamate (CAS 705-70-4) 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.
(4-fluorophenyl) N-methylcarbamate
Also Known As: 4-fluorophenyl n-methylcarbamate, 4-Fluorophenyl methylcarbamate, (4-fluorophenyl) N-methylcarbamate, GJDKAAGFLSFKKM-UHFFFAOYSA-, Methylcarbamic acid 4-fluorophenyl ester
| Molecular Formula | C8H8FNO2 |
|---|---|
| Molecular Weight | 169.05 g/mol |
| LogP | 1.5439 |
| 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 | 270.89127 |
Chemical Identifiers
| CAS Number | 705-70-4 |
|---|---|
| SMILES | CNC(=O)OC1=CC=C(C=C1)F |
Product Overview
4-Fluorophenyl methylcarbamate (CAS 705-70-4), with molecular formula C8H8FNO2 and molecular weight 169.05 g/mol. IUPAC: (4-fluorophenyl) N-methylcarbamate.
Chemical Property Profile of 4-Fluorophenyl methylcarbamate
Property Insights of 4-Fluorophenyl methylcarbamate
The XLogP value of 1.5439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorophenyl methylcarbamate. With a topological polar surface area (TPSA) of 38.33 Ų, 4-Fluorophenyl methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorophenyl methylcarbamate 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 4-Fluorophenyl methylcarbamate?
The CAS number of 4-Fluorophenyl methylcarbamate is 705-70-4.
What is the molecular formula of 4-Fluorophenyl methylcarbamate?
The molecular formula of 4-Fluorophenyl methylcarbamate is C8H8FNO2.
What is the molecular weight of 4-Fluorophenyl methylcarbamate?
The molecular weight of 4-Fluorophenyl methylcarbamate is 169.05 g/mol.
Where can I buy 4-Fluorophenyl methylcarbamate?
You can request a quote for 4-Fluorophenyl methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorophenyl methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorophenyl methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.