N-(2-bromoethyl)-4-fluorobenzamide
TL;DR: N-(2-bromoethyl)-4-fluorobenzamide (CAS 95383-37-2) is a chemical compound with molecular formula C9H9BrFNO and molecular weight 244.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromoethyl)-4-fluorobenzamide
Also Known As: N-(2-bromoethyl)-4-fluorobenzamide, 2-(BROMOETHYL)-4-FLUORBENZAMIDE, 2-bromo-1-(4-fluorobenzamido)ethane, N-(2-bromoethyl)-4-fluoro-benzamide, N-(2-bromo-ethyl)-4-fluoro-benzamide
| Molecular Formula | C9H9BrFNO |
|---|---|
| Molecular Weight | 244.99 g/mol |
| LogP | 1.9504 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.98515 |
| Heavy Atoms | 13 |
| Complexity | 286.1711 |
Chemical Identifiers
| CAS Number | 95383-37-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCCBr)F |
Product Overview
N-(2-bromoethyl)-4-fluorobenzamide (CAS 95383-37-2), with molecular formula C9H9BrFNO and molecular weight 244.99 g/mol. IUPAC: N-(2-bromoethyl)-4-fluorobenzamide.
Chemical Property Profile of N-(2-bromoethyl)-4-fluorobenzamide
Property Insights of N-(2-bromoethyl)-4-fluorobenzamide
The XLogP value of 1.9504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-bromoethyl)-4-fluorobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(2-bromoethyl)-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-bromoethyl)-4-fluorobenzamide has 1 hydrogen bond donor(s) and 1 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-bromoethyl)-4-fluorobenzamide?
The CAS number of N-(2-bromoethyl)-4-fluorobenzamide is 95383-37-2.
What is the molecular formula of N-(2-bromoethyl)-4-fluorobenzamide?
The molecular formula of N-(2-bromoethyl)-4-fluorobenzamide is C9H9BrFNO.
What is the molecular weight of N-(2-bromoethyl)-4-fluorobenzamide?
The molecular weight of N-(2-bromoethyl)-4-fluorobenzamide is 244.99 g/mol.
Where can I buy N-(2-bromoethyl)-4-fluorobenzamide?
You can request a quote for N-(2-bromoethyl)-4-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-bromoethyl)-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-bromoethyl)-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.