RefChem:1063411
TL;DR: RefChem:1063411 (CAS 58086-35-4) is a chemical compound with molecular formula C9H24Br2N2O and molecular weight 334.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-3-(trimethylazaniumyl)propyl]-trimethylazanium dibromide
Also Known As: (2-Hydroxytrimethylene)bis(trimethylammonium) dibromide, Ammonium, (2-hydroxytrimethylene)bis(trimethyl-, dibromide, 1,3-Propanediaminium, 2-hydroxy-N,N,N,N',N',N'-hexamethyl-, dibromide, 2-Hydroxy-N,N,N,N',N',N'-hexamethyl-1,3-propanediaminium dibromide, [2-hydroxy-3-(trimethylazaniumyl)propyl]-trimethylazanium
| Molecular Formula | C9H24Br2N2O |
|---|---|
| Molecular Weight | 334.03 g/mol |
| LogP | -6.23 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.0235 |
| Heavy Atoms | 14 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 58086-35-4 |
|---|---|
| SMILES | C[N+](C)(C)CC(C[N+](C)(C)C)O.[Br-].[Br-] |
| InChIKey | BIKNTKSEMWGCDC-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:1063411 (CAS 58086-35-4), with molecular formula C9H24Br2N2O and molecular weight 334.03 g/mol. IUPAC: [2-hydroxy-3-(trimethylazaniumyl)propyl]-trimethylazanium dibromide.
Chemical Property Profile of RefChem:1063411
Property Insights of RefChem:1063411
The XLogP value of -6.23 indicates that RefChem:1063411 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.2 Ų, RefChem:1063411 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1063411 has 1 hydrogen bond donor(s) and 3 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 RefChem:1063411?
The CAS number of RefChem:1063411 is 58086-35-4.
What is the molecular formula of RefChem:1063411?
The molecular formula of RefChem:1063411 is C9H24Br2N2O.
What is the molecular weight of RefChem:1063411?
The molecular weight of RefChem:1063411 is 334.03 g/mol.
Where can I buy RefChem:1063411?
You can request a quote for RefChem:1063411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1063411?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1063411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.