2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate
TL;DR: 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate (CAS 26516-15-4) is a chemical compound with molecular formula C13H8ClF2NO4S and molecular weight 346.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-fluoro-4-fluorosulfonylphenyl) N-(3-chlorophenyl)carbamate
Also Known As: 2-Fluoro-4-fluorosulfonylphenyl N-m-chlorophenyl-carbamate, 3-Fluoro-4-hydroxybenzenesulfonyl fluoride m-chlorocarbanilate, m-Chlorocarbanilic acid, 2-fluoro-4-fluorosulfonylphenyl ester, 2-fluoro-4-(fluorosulfonyl)phenyl(3-chlorophenyl)carbamate, Benzenesulfonyl fluoride, 3-fluoro-4-hydroxy-, m-chlorocarbanilate
| Molecular Formula | C13H8ClF2NO4S |
|---|---|
| Molecular Weight | 346.98 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.98306 |
| Heavy Atoms | 22 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 26516-15-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)OC2=C(C=C(C=C2)S(=O)(=O)F)F |
| InChIKey | BQALWMOTOVRDLI-UHFFFAOYSA-N |
Product Overview
2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate (CAS 26516-15-4), with molecular formula C13H8ClF2NO4S and molecular weight 346.98 g/mol. IUPAC: (2-fluoro-4-fluorosulfonylphenyl) N-(3-chlorophenyl)carbamate.
Chemical Property Profile of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate
Property Insights of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate
The XLogP value of 3.6 indicates that 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate. Following Lipinski's Rule of Five, 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate has 1 hydrogen bond donor(s) and 6 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-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate?
The CAS number of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate is 26516-15-4.
What is the molecular formula of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate?
The molecular formula of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate is C13H8ClF2NO4S.
What is the molecular weight of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate?
The molecular weight of 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate is 346.98 g/mol.
Where can I buy 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate?
You can request a quote for 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate 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-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-4-(fluorosulfonyl)phenyl hydrogen (3-chlorophenyl)carbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.