1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)
TL;DR: 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) (CAS 5412-25-9) is a chemical compound with molecular formula C6H11Br4O4P and molecular weight 493.71 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,3-dibromopropyl) hydrogen phosphate
Also Known As: Bis(2,3-dibromopropyl) phosphate, Bis(2,3-dibromopropyl)phosphate, Bis(2,3-dibromopropyl) hydrogen phosphate, BIS PHOSPHATE, BIS-BP
| Molecular Formula | C6H11Br4O4P |
|---|---|
| Molecular Weight | 493.71 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 497.70874 |
| Heavy Atoms | 15 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 5412-25-9 |
|---|---|
| SMILES | C(C(CBr)Br)OP(=O)(O)OCC(CBr)Br |
| InChIKey | CBPKIOGAUWKEFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) (CAS 5412-25-9), with molecular formula C6H11Br4O4P and molecular weight 493.71 g/mol. IUPAC: bis(2,3-dibromopropyl) hydrogen phosphate.
Chemical Property Profile of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)
Property Insights of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate). With a topological polar surface area (TPSA) of 55.8 Ų, 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) has 1 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 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)?
The CAS number of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) is 5412-25-9.
What is the molecular formula of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)?
The molecular formula of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) is C6H11Br4O4P.
What is the molecular weight of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)?
The molecular weight of 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) is 493.71 g/mol.
Where can I buy 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)?
You can request a quote for 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate)?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 2,3-dibromo-, 1,1'-(hydrogen phosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.