6-Chloro-3-indoxyl caprylate
TL;DR: 6-Chloro-3-indoxyl caprylate (CAS 159954-35-5) is a chemical compound with molecular formula C16H20ClNO2 and molecular weight 293.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6-chloro-1H-indol-3-yl) octanoate
Also Known As: 6-Chloro-3-indoxyl caprylate, 6-Chloro-1H-indol-3-yl octanoate, (6-chloro-1H-indol-3-yl) Octanoate, 6-Chloro-3-indoxyl octanoate, 5965AH
Technical Specifications
| Molecular Formula | C16H20ClNO2 |
| Molecular Weight | 293.11826 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 293.11826 Da |
| Heavy Atoms | 20 |
| Complexity | 311.0 |
| SMILES | CCCCCCCC(=O)OC1=CNC2=C1C=CC(=C2)Cl |
| InChIKey | KBOGGXOQZZEFSL-UHFFFAOYSA-N |
Chemical Property Profile of 6-Chloro-3-indoxyl caprylate
Property Insights of 6-Chloro-3-indoxyl caprylate
The XLogP value of 5.4 indicates that 6-Chloro-3-indoxyl caprylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, 6-Chloro-3-indoxyl caprylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-3-indoxyl caprylate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 6-Chloro-3-indoxyl caprylate?
The CAS number of 6-Chloro-3-indoxyl caprylate is 159954-35-5.
What is the molecular formula of 6-Chloro-3-indoxyl caprylate?
The molecular formula of 6-Chloro-3-indoxyl caprylate is C16H20ClNO2.
What is the molecular weight of 6-Chloro-3-indoxyl caprylate?
The molecular weight of 6-Chloro-3-indoxyl caprylate is 293.11826 g/mol.
Where can I buy 6-Chloro-3-indoxyl caprylate?
You can request a quote for 6-Chloro-3-indoxyl caprylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Chloro-3-indoxyl caprylate?
Yes, CoreyChem provides custom synthesis services for 6-Chloro-3-indoxyl caprylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.