3-fluoro-N-hexylbenzamide
TL;DR: 3-fluoro-N-hexylbenzamide (CAS 64181-39-1) is a chemical compound with molecular formula C13H18FNO and molecular weight 223.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-N-hexylbenzamide
Also Known As: 3-fluoro-N-hexylbenzamide, 3-Fluoro-N-hexyl-benzamide, Benzamide, 3-fluoro-N-hexyl-, (3-fluorophenyl)-N-hexylcarboxamide, BAS 00168310
| Molecular Formula | C13H18FNO |
|---|---|
| Molecular Weight | 223.14 g/mol |
| LogP | 3.1358 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.13724 |
| Heavy Atoms | 16 |
| Complexity | 338.4594 |
Chemical Identifiers
| CAS Number | 64181-39-1 |
|---|---|
| SMILES | CCCCCCNC(=O)C1=CC(=CC=C1)F |
Product Overview
3-fluoro-N-hexylbenzamide (CAS 64181-39-1), with molecular formula C13H18FNO and molecular weight 223.14 g/mol. IUPAC: 3-fluoro-N-hexylbenzamide.
Chemical Property Profile of 3-fluoro-N-hexylbenzamide
Property Insights of 3-fluoro-N-hexylbenzamide
The XLogP value of 3.1358 indicates that 3-fluoro-N-hexylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-fluoro-N-hexylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-fluoro-N-hexylbenzamide 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-fluoro-N-hexylbenzamide?
The CAS number of 3-fluoro-N-hexylbenzamide is 64181-39-1.
What is the molecular formula of 3-fluoro-N-hexylbenzamide?
The molecular formula of 3-fluoro-N-hexylbenzamide is C13H18FNO.
What is the molecular weight of 3-fluoro-N-hexylbenzamide?
The molecular weight of 3-fluoro-N-hexylbenzamide is 223.14 g/mol.
Where can I buy 3-fluoro-N-hexylbenzamide?
You can request a quote for 3-fluoro-N-hexylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-fluoro-N-hexylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-fluoro-N-hexylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.