Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester
TL;DR: Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester (CAS 60075-80-1) is a chemical compound with molecular formula C16H23IO3 and molecular weight 390.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl 3-(4-iodophenyl)propyl carbonate
Also Known As: hexyl 3-(4-iodophenyl)propyl carbonate, 3-(4-Iodophenyl)-1-propanol, n-Hexyl 3-(p-iodophenyl)propyl carbonate, CARBONIC ACID, HEXYL 3-(p-IODOPHENYL)PROPYL ESTER, Hexyl[3-(p-iodophenyl)propyl] =carbonate
| Molecular Formula | C16H23IO3 |
|---|---|
| Molecular Weight | 390.07 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 390.06918 |
| Heavy Atoms | 20 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 60075-80-1 |
|---|---|
| SMILES | CCCCCCOC(=O)OCCCC1=CC=C(C=C1)I |
| InChIKey | KQOKRJDDYJLNCW-UHFFFAOYSA-N |
Product Overview
Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester (CAS 60075-80-1), with molecular formula C16H23IO3 and molecular weight 390.07 g/mol. IUPAC: hexyl 3-(4-iodophenyl)propyl carbonate.
Chemical Property Profile of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester
Property Insights of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester
The XLogP value of 5.8 indicates that Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester 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 Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester?
The CAS number of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester is 60075-80-1.
What is the molecular formula of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester?
The molecular formula of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester is C16H23IO3.
What is the molecular weight of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester?
The molecular weight of Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester is 390.07 g/mol.
Where can I buy Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester?
You can request a quote for Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, hexyl 3-(p-iodophenyl)propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.