Diethyl 2-Bromoethoxymethylphosphonate
TL;DR: Diethyl 2-Bromoethoxymethylphosphonate (CAS 116385-33-2) is a chemical compound with molecular formula C21H24O6 and molecular weight 372.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2,4-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene
Also Known As: Diethyl 2-Bromoethoxymethylphosphonate, 8-(2,4-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene, 8-(2,4-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[, 5H-1,3-Dioxolo(4,5-g)(1)benzopyran, 8-(2,4-dimethoxyphenyl)-7,8-dihydr o-6-methoxy-6,7-dimethyl-, 5H-1,3-Dioxolo(4,5-g)(1)benzopyran, 8-(2,4-dimethoxyphenyl)-7,8-dihydro-6-methoxy-6,7-dimethyl-
| Molecular Formula | C21H24O6 |
|---|---|
| Molecular Weight | 372.16 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.1573 |
| Heavy Atoms | 27 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 116385-33-2 |
|---|---|
| SMILES | CC1C(C2=CC3=C(C=C2OC1(C)OC)OCO3)C4=C(C=C(C=C4)OC)OC |
| InChIKey | OJLSPKZVMHLCBB-UHFFFAOYSA-N |
Product Overview
Diethyl 2-Bromoethoxymethylphosphonate (CAS 116385-33-2), with molecular formula C21H24O6 and molecular weight 372.16 g/mol. IUPAC: 8-(2,4-dimethoxyphenyl)-6-methoxy-6,7-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromene.
Chemical Property Profile of Diethyl 2-Bromoethoxymethylphosphonate
Property Insights of Diethyl 2-Bromoethoxymethylphosphonate
The XLogP value of 4.1 indicates that Diethyl 2-Bromoethoxymethylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Diethyl 2-Bromoethoxymethylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 2-Bromoethoxymethylphosphonate 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 Diethyl 2-Bromoethoxymethylphosphonate?
The CAS number of Diethyl 2-Bromoethoxymethylphosphonate is 116385-33-2.
What is the molecular formula of Diethyl 2-Bromoethoxymethylphosphonate?
The molecular formula of Diethyl 2-Bromoethoxymethylphosphonate is C21H24O6.
What is the molecular weight of Diethyl 2-Bromoethoxymethylphosphonate?
The molecular weight of Diethyl 2-Bromoethoxymethylphosphonate is 372.16 g/mol.
Where can I buy Diethyl 2-Bromoethoxymethylphosphonate?
You can request a quote for Diethyl 2-Bromoethoxymethylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-Bromoethoxymethylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-Bromoethoxymethylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.