3-(4-Iodophenyl)butyl propan-2-yl carbonate
TL;DR: 3-(4-Iodophenyl)butyl propan-2-yl carbonate (CAS 60075-83-4) is a chemical compound with molecular formula C14H19IO3 and molecular weight 362.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-iodophenyl)butyl propan-2-yl carbonate
Also Known As: 3-(4-Iodophenyl)-1-propanol, 3-(4-iodophenyl)butyl propan-2-yl carbonate, Isopropyl[3-(p-iodophenyl)butyl] =carbonate, Carbonic acid 3-(p-iodophenyl)-3-methylpropyl isopropyl ester, CARBONIC ACID, ISOPROPYL ESTER, ESTER with 3-(p-IODOPHENYL)BUTANOL
| Molecular Formula | C14H19IO3 |
|---|---|
| Molecular Weight | 362.04 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 362.0379 |
| Heavy Atoms | 18 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 60075-83-4 |
|---|---|
| SMILES | CC(C)OC(=O)OCCC(C)C1=CC=C(C=C1)I |
| InChIKey | BWRLYESNWMEAGD-UHFFFAOYSA-N |
Product Overview
3-(4-Iodophenyl)butyl propan-2-yl carbonate (CAS 60075-83-4), with molecular formula C14H19IO3 and molecular weight 362.04 g/mol. IUPAC: 3-(4-iodophenyl)butyl propan-2-yl carbonate.
Chemical Property Profile of 3-(4-Iodophenyl)butyl propan-2-yl carbonate
Property Insights of 3-(4-Iodophenyl)butyl propan-2-yl carbonate
The XLogP value of 4.6 indicates that 3-(4-Iodophenyl)butyl propan-2-yl 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, 3-(4-Iodophenyl)butyl propan-2-yl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Iodophenyl)butyl propan-2-yl 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 3-(4-Iodophenyl)butyl propan-2-yl carbonate?
The CAS number of 3-(4-Iodophenyl)butyl propan-2-yl carbonate is 60075-83-4.
What is the molecular formula of 3-(4-Iodophenyl)butyl propan-2-yl carbonate?
The molecular formula of 3-(4-Iodophenyl)butyl propan-2-yl carbonate is C14H19IO3.
What is the molecular weight of 3-(4-Iodophenyl)butyl propan-2-yl carbonate?
The molecular weight of 3-(4-Iodophenyl)butyl propan-2-yl carbonate is 362.04 g/mol.
Where can I buy 3-(4-Iodophenyl)butyl propan-2-yl carbonate?
You can request a quote for 3-(4-Iodophenyl)butyl propan-2-yl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Iodophenyl)butyl propan-2-yl carbonate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Iodophenyl)butyl propan-2-yl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.