n-Hexylbenzamide
TL;DR: n-Hexylbenzamide (CAS 4773-75-5) is a chemical compound with molecular formula C13H19NO and molecular weight 205.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-hexylbenzamide
Also Known As: n-Hexylbenzamide, Benzamide, N-hexyl-, N-hexyl-benzamide, Benzamide,N-hexyl, n-Hexylbenzamide #
| Molecular Formula | C13H19NO |
|---|---|
| Molecular Weight | 205.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 205.14667 |
| Heavy Atoms | 15 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 4773-75-5 |
|---|---|
| SMILES | CCCCCCNC(=O)C1=CC=CC=C1 |
| InChIKey | MLDQPOXOWLCOEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-Hexylbenzamide (CAS 4773-75-5), with molecular formula C13H19NO and molecular weight 205.15 g/mol. IUPAC: N-hexylbenzamide.
Chemical Property Profile of n-Hexylbenzamide
Property Insights of n-Hexylbenzamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Hexylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, n-Hexylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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 n-Hexylbenzamide?
The CAS number of n-Hexylbenzamide is 4773-75-5.
What is the molecular formula of n-Hexylbenzamide?
The molecular formula of n-Hexylbenzamide is C13H19NO.
What is the molecular weight of n-Hexylbenzamide?
The molecular weight of n-Hexylbenzamide is 205.15 g/mol.
Where can I buy n-Hexylbenzamide?
You can request a quote for n-Hexylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Hexylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for n-Hexylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.