RefChem:319372
TL;DR: RefChem:319372 (CAS 66967-70-2) is a chemical compound with molecular formula C42H86Br2N2 and molecular weight 776.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-[6-[4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide
Also Known As: C42H86N2.2Br.3/2H2O, C42-H86-N2.2Br.3/2H2-O, Ammonium, hexamethylenebis((3-((2,6-dimethyl-2-isobutyl)cyclohexyl)-1-methyl)propyl)bis(dimethyl-, dibromide, sesquihydrate, 4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-[6-[4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide, AMMONIUM, HEXAMETHYLENEBIS((3-((2,6-DIMETHYL-2-ISOBUTYL)CYCLOHEXYL)-1-METHYL)PRO
| Molecular Formula | C42H86Br2N2 |
|---|---|
| Molecular Weight | 776.52 g/mol |
| LogP | 6.02 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 778.51373 |
| Heavy Atoms | 46 |
| Complexity | 732.0 |
Chemical Identifiers
| CAS Number | 66967-70-2 |
|---|---|
| SMILES | CC1CCCC(C1CCC(C)[N+](C)(C)CCCCCC[N+](C)(C)C(C)CCC2C(CCCC2(C)CC(C)C)C)(C)CC(C)C.[Br-].[Br-] |
| InChIKey | XWUVAZPSDKWXNG-UHFFFAOYSA-L |
Product Overview
RefChem:319372 (CAS 66967-70-2), with molecular formula C42H86Br2N2 and molecular weight 776.52 g/mol. IUPAC: 4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-[6-[4-[2,6-dimethyl-2-(2-methylpropyl)cyclohexyl]butan-2-yl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide.
Chemical Property Profile of RefChem:319372
Property Insights of RefChem:319372
The XLogP value of 6.02 indicates that RefChem:319372 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:319372 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319372 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:319372?
The CAS number of RefChem:319372 is 66967-70-2.
What is the molecular formula of RefChem:319372?
The molecular formula of RefChem:319372 is C42H86Br2N2.
What is the molecular weight of RefChem:319372?
The molecular weight of RefChem:319372 is 776.52 g/mol.
Where can I buy RefChem:319372?
You can request a quote for RefChem:319372 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319372?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319372 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.