4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate
TL;DR: 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate (CAS 73855-35-3) is a chemical compound with molecular formula C12H8Cl4N2O2 and molecular weight 351.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-chloro-2-(trichloromethyl)quinolin-4-yl] N-methylcarbamate
Also Known As: 4-Quinolinol, methylcarbamate, 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate, 3-Chloro-2-trichloromethyl-4-quinolinol methylcarbamate, 4-Quinolinol, methylcarbamate (ester), 4-Quinolinol, 3-chloro-2-(trichloromethyl)-, methylcarbamate (ester)
| Molecular Formula | C12H8Cl4N2O2 |
|---|---|
| Molecular Weight | 351.93 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.93103 |
| Heavy Atoms | 20 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 73855-35-3 |
|---|---|
| SMILES | CNC(=O)OC1=C(C(=NC2=CC=CC=C21)C(Cl)(Cl)Cl)Cl |
| InChIKey | LSZWFTSRRVKZLC-UHFFFAOYSA-N |
Product Overview
4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate (CAS 73855-35-3), with molecular formula C12H8Cl4N2O2 and molecular weight 351.93 g/mol. IUPAC: [3-chloro-2-(trichloromethyl)quinolin-4-yl] N-methylcarbamate.
Chemical Property Profile of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate
Property Insights of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate
The XLogP value of 4.1 indicates that 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate has 1 hydrogen bond donor(s) and 3 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-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate?
The CAS number of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate is 73855-35-3.
What is the molecular formula of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate?
The molecular formula of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate is C12H8Cl4N2O2.
What is the molecular weight of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate?
The molecular weight of 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate is 351.93 g/mol.
Where can I buy 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate?
You can request a quote for 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.