2,3-二溴丙基二甲基硫酸酯
TL;DR: 2,3-二溴丙基二甲基硫酸酯 (CAS 82682-96-0) is a chemical compound with molecular formula C5H11Br2O4P and molecular weight 323.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-二溴丙基二甲基硫酸酯
2,3-dibromopropyl dimethyl phosphate
Also Known As: 2,3-Dibromopropyl dimethylphosphate, 2,3-dibromopropyl dimethyl phosphate, phosphoricacid,2,3-dibromopropyldimethylester, (2,3-Dibromopropyl)dimethyl=phosphate, Phosphoric acid, 2,3-dibromopropyl dimethyl ester
| Molecular Formula | C5H11Br2O4P |
|---|---|
| Molecular Weight | 323.88 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.87616 |
| Heavy Atoms | 12 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 82682-96-0 |
|---|---|
| SMILES | COP(=O)(OC)OCC(CBr)Br |
| InChIKey | LLXYHTKVLGMPBV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-二溴丙基二甲基硫酸酯 (CAS 82682-96-0), with molecular formula C5H11Br2O4P and molecular weight 323.88 g/mol. IUPAC: 2,3-dibromopropyl dimethyl phosphate.
Chemical Property Profile of 2,3-二溴丙基二甲基硫酸酯
Property Insights of 2,3-二溴丙基二甲基硫酸酯
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-二溴丙基二甲基硫酸酯. With a topological polar surface area (TPSA) of 44.8 Ų, 2,3-二溴丙基二甲基硫酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-二溴丙基二甲基硫酸酯 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 2,3-二溴丙基二甲基硫酸酯?
The CAS number of 2,3-二溴丙基二甲基硫酸酯 is 82682-96-0.
What is the molecular formula of 2,3-二溴丙基二甲基硫酸酯?
The molecular formula of 2,3-二溴丙基二甲基硫酸酯 is C5H11Br2O4P.
What is the molecular weight of 2,3-二溴丙基二甲基硫酸酯?
The molecular weight of 2,3-二溴丙基二甲基硫酸酯 is 323.88 g/mol.
Where can I buy 2,3-二溴丙基二甲基硫酸酯?
You can request a quote for 2,3-二溴丙基二甲基硫酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-二溴丙基二甲基硫酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,3-二溴丙基二甲基硫酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.