2,2,2-Tribromoethyl dihydrogen phosphate
TL;DR: 2,2,2-Tribromoethyl dihydrogen phosphate (CAS 6027-15-2) is a chemical compound with molecular formula C2H4Br3O4P and molecular weight 359.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-tribromoethyl dihydrogen phosphate
Also Known As: 2,2,2-tribromoethyl dihydrogen phosphate, 2.2.2-Tribrom-aethanol-phosphorsaeureester
| Molecular Formula | C2H4Br3O4P |
|---|---|
| Molecular Weight | 359.74 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.73972 |
| Heavy Atoms | 10 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 6027-15-2 |
|---|---|
| SMILES | C(C(Br)(Br)Br)OP(=O)(O)O |
| InChIKey | NIHRETFAEJQJKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,2-Tribromoethyl dihydrogen phosphate (CAS 6027-15-2), with molecular formula C2H4Br3O4P and molecular weight 359.74 g/mol. IUPAC: 2,2,2-tribromoethyl dihydrogen phosphate.
Chemical Property Profile of 2,2,2-Tribromoethyl dihydrogen phosphate
Property Insights of 2,2,2-Tribromoethyl dihydrogen phosphate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-Tribromoethyl dihydrogen phosphate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-Tribromoethyl dihydrogen phosphate. Following Lipinski's Rule of Five, 2,2,2-Tribromoethyl dihydrogen phosphate has 2 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 2,2,2-Tribromoethyl dihydrogen phosphate?
The CAS number of 2,2,2-Tribromoethyl dihydrogen phosphate is 6027-15-2.
What is the molecular formula of 2,2,2-Tribromoethyl dihydrogen phosphate?
The molecular formula of 2,2,2-Tribromoethyl dihydrogen phosphate is C2H4Br3O4P.
What is the molecular weight of 2,2,2-Tribromoethyl dihydrogen phosphate?
The molecular weight of 2,2,2-Tribromoethyl dihydrogen phosphate is 359.74 g/mol.
Where can I buy 2,2,2-Tribromoethyl dihydrogen phosphate?
You can request a quote for 2,2,2-Tribromoethyl dihydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Tribromoethyl dihydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Tribromoethyl dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.