1,3-Benzodioxol-5-yl diethyl phosphate
TL;DR: 1,3-Benzodioxol-5-yl diethyl phosphate (CAS 6319-31-9) is a chemical compound with molecular formula C11H15O6P and molecular weight 274.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzodioxol-5-yl diethyl phosphate
Also Known As: 1,3-benzodioxol-5-yl diethyl phosphate, Phosphoricacid, 1,3-benzodioxol-5-yl diethyl ester, Diaethyl-<3,4-methylendioxy-phenyl>-phosphat, 2H-1,3-BENZODIOXOL-5-YL DIETHYL PHOSPHATE, RefChem:217835
| Molecular Formula | C11H15O6P |
|---|---|
| Molecular Weight | 274.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.06064 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 6319-31-9 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CC2=C(C=C1)OCO2 |
| InChIKey | UIZVRCFBAYXMGM-UHFFFAOYSA-N |
Product Overview
1,3-Benzodioxol-5-yl diethyl phosphate (CAS 6319-31-9), with molecular formula C11H15O6P and molecular weight 274.06 g/mol. IUPAC: 1,3-benzodioxol-5-yl diethyl phosphate.
Chemical Property Profile of 1,3-Benzodioxol-5-yl diethyl phosphate
Property Insights of 1,3-Benzodioxol-5-yl diethyl phosphate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzodioxol-5-yl diethyl phosphate. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzodioxol-5-yl diethyl phosphate. Following Lipinski's Rule of Five, 1,3-Benzodioxol-5-yl diethyl phosphate has 0 hydrogen bond donor(s) and 6 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 1,3-Benzodioxol-5-yl diethyl phosphate?
The CAS number of 1,3-Benzodioxol-5-yl diethyl phosphate is 6319-31-9.
What is the molecular formula of 1,3-Benzodioxol-5-yl diethyl phosphate?
The molecular formula of 1,3-Benzodioxol-5-yl diethyl phosphate is C11H15O6P.
What is the molecular weight of 1,3-Benzodioxol-5-yl diethyl phosphate?
The molecular weight of 1,3-Benzodioxol-5-yl diethyl phosphate is 274.06 g/mol.
Where can I buy 1,3-Benzodioxol-5-yl diethyl phosphate?
You can request a quote for 1,3-Benzodioxol-5-yl diethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxol-5-yl diethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxol-5-yl diethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.