3-Bromo-4-fluorobenzamide
TL;DR: 3-Bromo-4-fluorobenzamide (CAS 455-85-6) is a chemical compound with molecular formula C7H5BrFNO and molecular weight 216.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-fluorobenzamide
Also Known As: 3-bromo-4-fluorobenzamide, 3-bromo-4-fluoro-benzamide, Benzamide,3-bromo-4-fluoro-, BUTTPARK 81\01-06, 2-bromo-4-carbamoyl-1-fluorobenzene
| Molecular Formula | C7H5BrFNO |
|---|---|
| Molecular Weight | 216.95 g/mol |
| LogP | 1.6871 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.95386 |
| Heavy Atoms | 11 |
| Complexity | 300.4921 |
Chemical Identifiers
| CAS Number | 455-85-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)N)Br)F |
Product Overview
3-Bromo-4-fluorobenzamide (CAS 455-85-6), with molecular formula C7H5BrFNO and molecular weight 216.95 g/mol. IUPAC: 3-bromo-4-fluorobenzamide.
Chemical Property Profile of 3-Bromo-4-fluorobenzamide
Property Insights of 3-Bromo-4-fluorobenzamide
The XLogP value of 1.6871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-4-fluorobenzamide. With a topological polar surface area (TPSA) of 43.09 Ų, 3-Bromo-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-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 3-Bromo-4-fluorobenzamide?
The CAS number of 3-Bromo-4-fluorobenzamide is 455-85-6.
What is the molecular formula of 3-Bromo-4-fluorobenzamide?
The molecular formula of 3-Bromo-4-fluorobenzamide is C7H5BrFNO.
What is the molecular weight of 3-Bromo-4-fluorobenzamide?
The molecular weight of 3-Bromo-4-fluorobenzamide is 216.95 g/mol.
Where can I buy 3-Bromo-4-fluorobenzamide?
You can request a quote for 3-Bromo-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.