RefChem:319131
TL;DR: RefChem:319131 (CAS 66902-75-8) is a chemical compound with molecular formula C34H66Cl2N2 and molecular weight 572.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]but-2-ynyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride
Also Known As: Ammonium, 2-butynylenebis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dichloride, dihydrate, 4-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]but-2-ynyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride, AMMONIUM, 2-BUTYNYLENEBIS(1-METHYL-3-(2,2,6-TRIMETHYLCYCLOHEXYL)PROPYL)BIS(DIMET, 2-Butyne-1,4-diaminium, N,N,N',N'-tetramethyl-N,N'-bis[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]-, dichloride, dihydrate, N~1~,N~1~,N~4~,N~4~-Tetramethyl-N~1~,N~4~-bis[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]but-2-yne-1,4-bis(aminium) dichloride
| Molecular Formula | C34H66Cl2N2 |
|---|---|
| Molecular Weight | 572.46 g/mol |
| LogP | 2.41 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 572.4603 |
| Heavy Atoms | 38 |
| Complexity | 686.0 |
Chemical Identifiers
| CAS Number | 66902-75-8 |
|---|---|
| SMILES | CC1CCCC(C1CCC(C)[N+](C)(C)CC#CC[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)(C)C.[Cl-].[Cl-] |
| InChIKey | ZDUDVOIFULQFIF-UHFFFAOYSA-L |
Product Overview
RefChem:319131 (CAS 66902-75-8), with molecular formula C34H66Cl2N2 and molecular weight 572.46 g/mol. IUPAC: 4-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]but-2-ynyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dichloride.
Chemical Property Profile of RefChem:319131
Property Insights of RefChem:319131
The XLogP value of 2.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319131. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:319131 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319131 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:319131?
The CAS number of RefChem:319131 is 66902-75-8.
What is the molecular formula of RefChem:319131?
The molecular formula of RefChem:319131 is C34H66Cl2N2.
What is the molecular weight of RefChem:319131?
The molecular weight of RefChem:319131 is 572.46 g/mol.
Where can I buy RefChem:319131?
You can request a quote for RefChem:319131 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319131?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319131 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.