Phosphonic acid, styryl-, dibutyl ester
TL;DR: Phosphonic acid, styryl-, dibutyl ester (CAS 4124-95-2) is a chemical compound with molecular formula C16H25O3P and molecular weight 296.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dibutoxyphosphorylethenylbenzene
Also Known As: Dibutyl styrylphosphonate, 2-dibutoxyphosphorylethenylbenzene, Phosphonic acid, styryl-, dibutyl ester, beta-Styrenephosphonic acid, dibutyl ester, AI3-19533
| Molecular Formula | C16H25O3P |
|---|---|
| Molecular Weight | 296.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 296.15414 |
| Heavy Atoms | 20 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 4124-95-2 |
|---|---|
| SMILES | CCCCOP(=O)(C=CC1=CC=CC=C1)OCCCC |
| InChIKey | ZUPNFVVGFGXAQB-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, styryl-, dibutyl ester (CAS 4124-95-2), with molecular formula C16H25O3P and molecular weight 296.15 g/mol. IUPAC: 2-dibutoxyphosphorylethenylbenzene.
Chemical Property Profile of Phosphonic acid, styryl-, dibutyl ester
Property Insights of Phosphonic acid, styryl-, dibutyl ester
The XLogP value of 4.0 indicates that Phosphonic acid, styryl-, dibutyl 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, Phosphonic acid, styryl-, dibutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, styryl-, dibutyl ester 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 Phosphonic acid, styryl-, dibutyl ester?
The CAS number of Phosphonic acid, styryl-, dibutyl ester is 4124-95-2.
What is the molecular formula of Phosphonic acid, styryl-, dibutyl ester?
The molecular formula of Phosphonic acid, styryl-, dibutyl ester is C16H25O3P.
What is the molecular weight of Phosphonic acid, styryl-, dibutyl ester?
The molecular weight of Phosphonic acid, styryl-, dibutyl ester is 296.15 g/mol.
Where can I buy Phosphonic acid, styryl-, dibutyl ester?
You can request a quote for Phosphonic acid, styryl-, dibutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, styryl-, dibutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, styryl-, dibutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.