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RefChem:1090218 structure
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RefChem:1090218

TL;DR: RefChem:1090218 (CAS 10066-72-5) is a chemical compound with molecular formula C32H48I2N2O4 and molecular weight 778.17035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[3-[2-[diethyl(methyl)azaniumyl]ethoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxyethyl-diethyl-methylazanium diiodide

Also Known As: 2-[3-[2-[diethyl(methyl)azaniumyl]ethoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxyethyl-diethyl-methylazanium diiodide, Ammonium, diethyl(2-hydroxyethyl)methyl-, iodide, ester with (cis-1,2,trans-1,3,trans-1,4)-2,4-diphenyl-1,3-cyclobutanedicarboxylic acid (2:1), AMMONIUM, DIETHYL(2-HYDROXYETHYL)METHYL-, IODIDE, ESTER with (cis-1,2,trans-1,3,, 2-[3-[2-[diethyl(methyl)azaniumyl]ethoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxyethyl-diethyl-methylazanium, N,N'-((2,4-Diphenylcyclobutane-1,3-diyl)bis(carbonyloxyethane-2,1-diyl))bis(N-ethyl-N-methylethan-1-aminium) diiodide

CAS Number
10066-72-5
Molecular Formula
C32H48I2N2O4
Molecular Weight
778.17035 g/mol
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Technical Specifications

Molecular FormulaC32H48I2N2O4
Molecular Weight778.17035 g/mol
XLogP-1.13
Topological Polar Surface Area (TPSA)52.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds16
Exact Mass778.17035 Da
Heavy Atoms40
Complexity662.0
SMILESCC[N+](C)(CC)CCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCC[N+](C)(CC)CC)C3=CC=CC=C3.[I-].[I-]
InChIKeyVSFHPDMZQSQFES-UHFFFAOYSA-L

Chemical Property Profile of RefChem:1090218

XLogP
-1.13
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
16
Heavy Atoms
40
Complexity
662.0
Exact Mass
778.17035
Monoisotopic Mass
778.17035
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of RefChem:1090218

The XLogP value of -1.13 indicates that RefChem:1090218 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:1090218 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090218 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:1090218?

The CAS number of RefChem:1090218 is 10066-72-5.

What is the molecular formula of RefChem:1090218?

The molecular formula of RefChem:1090218 is C32H48I2N2O4.

What is the molecular weight of RefChem:1090218?

The molecular weight of RefChem:1090218 is 778.17035 g/mol.

Where can I buy RefChem:1090218?

You can request a quote for RefChem:1090218 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1090218?

Yes, CoreyChem provides custom synthesis services for RefChem:1090218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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