4-氯苯基磷酸二乙酯
TL;DR: 4-氯苯基磷酸二乙酯 (CAS 5076-63-1) is a chemical compound with molecular formula C10H14ClO4P and molecular weight 264.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯苯基磷酸二乙酯
(4-chlorophenyl) diethyl phosphate
Also Known As: p-Methoxyphenetole, 4-chlorophenyl diethyl phosphate, Diethyl 4-chlorophenyl phosphate, (4-chlorophenyl) diethyl phosphate, p-Chlorophenyl diethyl phosphate
| Molecular Formula | C10H14ClO4P |
|---|---|
| Molecular Weight | 264.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.03183 |
| Heavy Atoms | 16 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 5076-63-1 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CC=C(C=C1)Cl |
| InChIKey | LBGVKIMCKGXEEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯苯基磷酸二乙酯 (CAS 5076-63-1), with molecular formula C10H14ClO4P and molecular weight 264.03 g/mol. IUPAC: (4-chlorophenyl) diethyl phosphate.
Chemical Property Profile of 4-氯苯基磷酸二乙酯
Property Insights of 4-氯苯基磷酸二乙酯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯苯基磷酸二乙酯. With a topological polar surface area (TPSA) of 44.8 Ų, 4-氯苯基磷酸二乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯苯基磷酸二乙酯 has 0 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 4-氯苯基磷酸二乙酯?
The CAS number of 4-氯苯基磷酸二乙酯 is 5076-63-1.
What is the molecular formula of 4-氯苯基磷酸二乙酯?
The molecular formula of 4-氯苯基磷酸二乙酯 is C10H14ClO4P.
What is the molecular weight of 4-氯苯基磷酸二乙酯?
The molecular weight of 4-氯苯基磷酸二乙酯 is 264.03 g/mol.
Where can I buy 4-氯苯基磷酸二乙酯?
You can request a quote for 4-氯苯基磷酸二乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯苯基磷酸二乙酯?
Yes, KEHONG BIO provides custom synthesis services for 4-氯苯基磷酸二乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.