3,4-Difluorobenzamide
TL;DR: 3,4-Difluorobenzamide (CAS 9049-11-0) is a chemical compound with molecular formula C7H5F2NO and molecular weight 157.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-difluorobenzamide
Also Known As: 3,4-Difluorobenzamide, 3,4-Difluoro-benzamide, 3,4-diflurobenzamide, Benzamide, 3,4-fluoro-, 3,4-Difluorobenzamide #
| Molecular Formula | C7H5F2NO |
|---|---|
| Molecular Weight | 157.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.03392 |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 9049-11-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)N)F)F |
| InChIKey | CMWOHNIHUBDEAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Difluorobenzamide (CAS 9049-11-0), with molecular formula C7H5F2NO and molecular weight 157.03 g/mol. IUPAC: 3,4-difluorobenzamide.
Chemical Property Profile of 3,4-Difluorobenzamide
Property Insights of 3,4-Difluorobenzamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Difluorobenzamide. With a topological polar surface area (TPSA) of 43.1 Ų, 3,4-Difluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Difluorobenzamide 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 3,4-Difluorobenzamide?
The CAS number of 3,4-Difluorobenzamide is 9049-11-0.
What is the molecular formula of 3,4-Difluorobenzamide?
The molecular formula of 3,4-Difluorobenzamide is C7H5F2NO.
What is the molecular weight of 3,4-Difluorobenzamide?
The molecular weight of 3,4-Difluorobenzamide is 157.03 g/mol.
Where can I buy 3,4-Difluorobenzamide?
You can request a quote for 3,4-Difluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Difluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Difluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.