RefChem:319391
TL;DR: RefChem:319391 (CAS 66967-75-7) 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.
6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide
Also Known As: Ammonium, hexamethylenebis(4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl)bis(dimethyl-, dibromide, 1,6-Hexanediaminium, N,N,N',N'-tetramethyl-N,N'-bis[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]-, dibromide, 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide, N~1~,N~1~,N~6~,N~6~-Tetramethyl-N~1~,N~6~-bis[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]hexane-1,6-bis(aminium) dibromide, RefChem:319391
| Molecular Formula | C42H86Br2N2 |
|---|---|
| Molecular Weight | 776.52 g/mol |
| LogP | 6.03 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 778.51373 |
| Heavy Atoms | 46 |
| Complexity | 700.0 |
Chemical Identifiers
| CAS Number | 66967-75-7 |
|---|---|
| SMILES | CC1CCCC(C1CCC(C)CCC[N+](C)(C)CCCCCC[N+](C)(C)CCCC(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-] |
| InChIKey | RAKHMMSHZSRVOA-UHFFFAOYSA-L |
Product Overview
RefChem:319391 (CAS 66967-75-7), with molecular formula C42H86Br2N2 and molecular weight 776.52 g/mol. IUPAC: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide.
Chemical Property Profile of RefChem:319391
Property Insights of RefChem:319391
The XLogP value of 6.03 indicates that RefChem:319391 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:319391 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319391 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:319391?
The CAS number of RefChem:319391 is 66967-75-7.
What is the molecular formula of RefChem:319391?
The molecular formula of RefChem:319391 is C42H86Br2N2.
What is the molecular weight of RefChem:319391?
The molecular weight of RefChem:319391 is 776.52 g/mol.
Where can I buy RefChem:319391?
You can request a quote for RefChem:319391 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319391?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319391 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.