4-Chlorophenyl methyl ethylphosphonate
TL;DR: 4-Chlorophenyl methyl ethylphosphonate (CAS 33232-87-0) is a chemical compound with molecular formula C9H12ClO3P and molecular weight 234.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[ethyl(methoxy)phosphoryl]oxybenzene
Also Known As: 4-chlorophenyl methyl ethylphosphonate, p-Chlorophenyl methyl ethylphosphonate, Phosphonic acid, ethyl-, p-chlorophenyl methyl ester, Ethylphosphonicacidmethyl4-chlorophenylester, 1-chloro-4-[ethyl(methoxy)phosphoryl]oxybenzene
| Molecular Formula | C9H12ClO3P |
|---|---|
| Molecular Weight | 234.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.02126 |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 33232-87-0 |
|---|---|
| SMILES | CCP(=O)(OC)OC1=CC=C(C=C1)Cl |
| InChIKey | LTMFLDGAGUOMEM-UHFFFAOYSA-N |
Product Overview
4-Chlorophenyl methyl ethylphosphonate (CAS 33232-87-0), with molecular formula C9H12ClO3P and molecular weight 234.02 g/mol. IUPAC: 1-chloro-4-[ethyl(methoxy)phosphoryl]oxybenzene.
Chemical Property Profile of 4-Chlorophenyl methyl ethylphosphonate
Property Insights of 4-Chlorophenyl methyl ethylphosphonate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chlorophenyl methyl ethylphosphonate. With a topological polar surface area (TPSA) of 35.5 Ų, 4-Chlorophenyl methyl ethylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chlorophenyl methyl ethylphosphonate 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 4-Chlorophenyl methyl ethylphosphonate?
The CAS number of 4-Chlorophenyl methyl ethylphosphonate is 33232-87-0.
What is the molecular formula of 4-Chlorophenyl methyl ethylphosphonate?
The molecular formula of 4-Chlorophenyl methyl ethylphosphonate is C9H12ClO3P.
What is the molecular weight of 4-Chlorophenyl methyl ethylphosphonate?
The molecular weight of 4-Chlorophenyl methyl ethylphosphonate is 234.02 g/mol.
Where can I buy 4-Chlorophenyl methyl ethylphosphonate?
You can request a quote for 4-Chlorophenyl methyl ethylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chlorophenyl methyl ethylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for 4-Chlorophenyl methyl ethylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.