N-(2-Chloroethyl)-p-fluorobenzamide
TL;DR: N-(2-Chloroethyl)-p-fluorobenzamide (CAS 15258-01-2) is a chemical compound with molecular formula C9H9ClFNO and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)-4-fluorobenzamide
Also Known As: n-(2-chloroethyl)-4-fluorobenzamide, (2-CHLOROETHYL)-4-FLUOROBENZAMIDE, N-(2-Chloroethyl)-p-fluorobenzamide, (2-Chloro-ethyl-)-4-fluoro-benz-amide, (S)-(-)-1,1,2-Triphenylethane-1,2-diol
| Molecular Formula | C9H9ClFNO |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.03568 |
| Heavy Atoms | 13 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 15258-01-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCCCl)F |
| InChIKey | GVQSSTGJCFQQCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-Chloroethyl)-p-fluorobenzamide (CAS 15258-01-2), with molecular formula C9H9ClFNO and molecular weight 201.04 g/mol. IUPAC: N-(2-chloroethyl)-4-fluorobenzamide.
Chemical Property Profile of N-(2-Chloroethyl)-p-fluorobenzamide
Property Insights of N-(2-Chloroethyl)-p-fluorobenzamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Chloroethyl)-p-fluorobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-Chloroethyl)-p-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)-p-fluorobenzamide 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 N-(2-Chloroethyl)-p-fluorobenzamide?
The CAS number of N-(2-Chloroethyl)-p-fluorobenzamide is 15258-01-2.
What is the molecular formula of N-(2-Chloroethyl)-p-fluorobenzamide?
The molecular formula of N-(2-Chloroethyl)-p-fluorobenzamide is C9H9ClFNO.
What is the molecular weight of N-(2-Chloroethyl)-p-fluorobenzamide?
The molecular weight of N-(2-Chloroethyl)-p-fluorobenzamide is 201.04 g/mol.
Where can I buy N-(2-Chloroethyl)-p-fluorobenzamide?
You can request a quote for N-(2-Chloroethyl)-p-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloroethyl)-p-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)-p-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.