3-(对碘苯基)丁基己基碳酸酯
TL;DR: 3-(对碘苯基)丁基己基碳酸酯 (CAS 60075-84-5) is a chemical compound with molecular formula C17H25IO3 and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(对碘苯基)丁基己基碳酸酯
hexyl 3-(4-iodophenyl)butyl carbonate
Also Known As: Hexyl3- butyl=carbonate, hexyl 3-(4-iodophenyl)butyl carbonate, 3-(4-Iodophenyl)-1-propanol, n-Hexyl 3-(p-iodophenyl)butyl carbonate, Hexyl 3-(p-iodophenyl)butyl=carbonate
| Molecular Formula | C17H25IO3 |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 404.08484 |
| Heavy Atoms | 21 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 60075-84-5 |
|---|---|
| SMILES | CCCCCCOC(=O)OCCC(C)C1=CC=C(C=C1)I |
| InChIKey | CSNJHTNBRRBHSS-UHFFFAOYSA-N |
Product Overview
3-(对碘苯基)丁基己基碳酸酯 (CAS 60075-84-5), with molecular formula C17H25IO3 and molecular weight 404.08 g/mol. IUPAC: hexyl 3-(4-iodophenyl)butyl carbonate.
Chemical Property Profile of 3-(对碘苯基)丁基己基碳酸酯
Property Insights of 3-(对碘苯基)丁基己基碳酸酯
The XLogP value of 6.1 indicates that 3-(对碘苯基)丁基己基碳酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3-(对碘苯基)丁基己基碳酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(对碘苯基)丁基己基碳酸酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(对碘苯基)丁基己基碳酸酯?
The CAS number of 3-(对碘苯基)丁基己基碳酸酯 is 60075-84-5.
What is the molecular formula of 3-(对碘苯基)丁基己基碳酸酯?
The molecular formula of 3-(对碘苯基)丁基己基碳酸酯 is C17H25IO3.
What is the molecular weight of 3-(对碘苯基)丁基己基碳酸酯?
The molecular weight of 3-(对碘苯基)丁基己基碳酸酯 is 404.08 g/mol.
Where can I buy 3-(对碘苯基)丁基己基碳酸酯?
You can request a quote for 3-(对碘苯基)丁基己基碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(对碘苯基)丁基己基碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 3-(对碘苯基)丁基己基碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.