Ethyl 3-(4-iodophenyl)propyl carbonate
TL;DR: Ethyl 3-(4-iodophenyl)propyl carbonate (CAS 60075-79-8) is a chemical compound with molecular formula C12H15IO3 and molecular weight 334.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-iodophenyl)propyl carbonate
Also Known As: ethyl 3-(4-iodophenyl)propyl carbonate, 3-(4-Iodophenyl)-1-propanol, Carbonic acid, ethyl 3-(4-iodophenyl)propyl ester, Carbonic acid ethyl 3-(p-iodophenyl)propyl ester, CARBONIC ACID, ETHYL 3-(p-IODOPHENYL)PROPYL ESTER
| Molecular Formula | C12H15IO3 |
|---|---|
| Molecular Weight | 334.01 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.0066 |
| Heavy Atoms | 16 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 60075-79-8 |
|---|---|
| SMILES | CCOC(=O)OCCCC1=CC=C(C=C1)I |
| InChIKey | PWBZVZALMHJNQE-UHFFFAOYSA-N |
Product Overview
Ethyl 3-(4-iodophenyl)propyl carbonate (CAS 60075-79-8), with molecular formula C12H15IO3 and molecular weight 334.01 g/mol. IUPAC: ethyl 3-(4-iodophenyl)propyl carbonate.
Chemical Property Profile of Ethyl 3-(4-iodophenyl)propyl carbonate
Property Insights of Ethyl 3-(4-iodophenyl)propyl carbonate
The XLogP value of 3.8 indicates that Ethyl 3-(4-iodophenyl)propyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 3-(4-iodophenyl)propyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(4-iodophenyl)propyl carbonate has 0 hydrogen bond donor(s) and 3 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 Ethyl 3-(4-iodophenyl)propyl carbonate?
The CAS number of Ethyl 3-(4-iodophenyl)propyl carbonate is 60075-79-8.
What is the molecular formula of Ethyl 3-(4-iodophenyl)propyl carbonate?
The molecular formula of Ethyl 3-(4-iodophenyl)propyl carbonate is C12H15IO3.
What is the molecular weight of Ethyl 3-(4-iodophenyl)propyl carbonate?
The molecular weight of Ethyl 3-(4-iodophenyl)propyl carbonate is 334.01 g/mol.
Where can I buy Ethyl 3-(4-iodophenyl)propyl carbonate?
You can request a quote for Ethyl 3-(4-iodophenyl)propyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(4-iodophenyl)propyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4-iodophenyl)propyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.