RefChem:1072107
TL;DR: RefChem:1072107 (CAS 10066-76-9) is a chemical compound with molecular formula C38H60I2N2O4 and molecular weight 862.2642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[3-[5-[diethyl(methyl)azaniumyl]pentoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxypentyl-diethyl-methylazanium diiodide
Also Known As: 5-[3-[5-[diethyl(methyl)azaniumyl]pentoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxypentyl-diethyl-methylazanium diiodide, Ammonium, diethyl(5-hydroxypentyl)methyl-, iodide, ester with (cis-1,2,trans-1,3,trans-1,4)-2,4-diphenyl-1,3-cyclobutanedicarboxylic acid (2:1), AMMONIUM, DIETHYL(5-HYDROXYPENTYL)METHYL-, IODIDE, ESTER with (cis-1,2,trans-1,3, 5,5'-((2,4-Diphenylcyclobutane-1,3-diyl)bis(carbonyloxy))bis(N,N-diethyl-N-methylpentan-1-aminium) diiodide, 5,5'-[(2,4-diphenylcyclobutane-1,3-diyl)bis(carbonyloxy)]bis(N,N-diethyl-N-methylpentan-1-aminium) diiodide
Technical Specifications
| Molecular Formula | C38H60I2N2O4 |
| Molecular Weight | 862.2642 g/mol |
| XLogP | 1.21 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 862.2642 Da |
| Heavy Atoms | 46 |
| Complexity | 747.0 |
| SMILES | CC[N+](C)(CC)CCCCCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCCCCC[N+](C)(CC)CC)C3=CC=CC=C3.[I-].[I-] |
| InChIKey | HZJNHORPHINCHO-UHFFFAOYSA-L |
Chemical Property Profile of RefChem:1072107
Property Insights of RefChem:1072107
The XLogP value of 1.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1072107. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:1072107 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1072107 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1072107?
The CAS number of RefChem:1072107 is 10066-76-9.
What is the molecular formula of RefChem:1072107?
The molecular formula of RefChem:1072107 is C38H60I2N2O4.
What is the molecular weight of RefChem:1072107?
The molecular weight of RefChem:1072107 is 862.2642 g/mol.
Where can I buy RefChem:1072107?
You can request a quote for RefChem:1072107 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1072107?
Yes, CoreyChem provides custom synthesis services for RefChem:1072107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.