RefChem:370480
TL;DR: RefChem:370480 (CAS 55338-84-6) is a chemical compound with molecular formula C13H17ClIO4P and molecular weight 429.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-diethoxyphosphoryl-3-(4-iodophenyl)prop-2-en-1-ol
Also Known As: Phosphonic acid, [3-chloro-1-hydroxy-3-(4-iodophenyl)-2-propenyl]-, diethyl ester, 3-chloro-1-diethoxyphosphoryl-3-(4-iodophenyl)prop-2-en-1-ol, diethyl [3-chloro-1-hydroxy-3-(4-iodophenyl)allyl]phosphonate, Diethyl [3-chloro-1-hydroxy-3-(4-iodophenyl)prop-2-en-1-yl]phosphonate, Phosphonic acid, (3-chloro-1-hydroxy-3-(4-iodophenyl)-2-propenyl)-, diethyl ester
| Molecular Formula | C13H17ClIO4P |
|---|---|
| Molecular Weight | 429.96 g/mol |
| LogP | 4.4554 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.95978 |
| Heavy Atoms | 20 |
| Complexity | 493.59753 |
Chemical Identifiers
| CAS Number | 55338-84-6 |
|---|---|
| SMILES | CCOP(=O)(C(C=C(C1=CC=C(C=C1)I)Cl)O)OCC |
Product Overview
RefChem:370480 (CAS 55338-84-6), with molecular formula C13H17ClIO4P and molecular weight 429.96 g/mol. IUPAC: 3-chloro-1-diethoxyphosphoryl-3-(4-iodophenyl)prop-2-en-1-ol.
Chemical Property Profile of RefChem:370480
Property Insights of RefChem:370480
The XLogP value of 4.4554 indicates that RefChem:370480 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, RefChem:370480 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:370480 has 1 hydrogen bond donor(s) and 4 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 RefChem:370480?
The CAS number of RefChem:370480 is 55338-84-6.
What is the molecular formula of RefChem:370480?
The molecular formula of RefChem:370480 is C13H17ClIO4P.
What is the molecular weight of RefChem:370480?
The molecular weight of RefChem:370480 is 429.96 g/mol.
Where can I buy RefChem:370480?
You can request a quote for RefChem:370480 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:370480?
Yes, KEHONG BIO provides custom synthesis services for RefChem:370480 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.