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Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester structure
Fine Chemical

Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester

TL;DR: Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester (CAS 10526-15-5) is a chemical compound with molecular formula C22H42O4S and molecular weight 402.2804 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-ethylhexyl 3-[3-(2-ethylhexoxy)-3-oxopropyl]sulfanylpropanoate

Also Known As: Bis(2-ethylhexyl) 3,3'-thiodipropionate, Bis(2-ethylhexyl)thiodipropionate, DI-2-ETHYLHEXYL 3,3-THIODIPROPIONATE, AI3-22637, DI-2-ETHYLHEXYL 3,3'-THIODIPROPIONATE

CAS Number
10526-15-5
Molecular Formula
C22H42O4S
Molecular Weight
402.2804 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Coatings & Adhesives (4 patents) Plastic Additives (1 patents) Polymer Intermediates (5 patents)

Technical Specifications

Molecular FormulaC22H42O4S
Molecular Weight402.2804 g/mol
XLogP6.8
Topological Polar Surface Area (TPSA)77.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds20
Exact Mass402.2804 Da
Heavy Atoms27
Complexity339.0
SMILESCCCCC(CC)COC(=O)CCSCCC(=O)OCC(CC)CCCC
InChIKeyNKNLSBYMGKTWDT-UHFFFAOYSA-N

Chemical Property Profile of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester

XLogP
6.8
TPSA (Topological Polar Surface Area)
77.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
20
Heavy Atoms
27
Complexity
339.0
Exact Mass
402.2804
Monoisotopic Mass
402.2804
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 Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester

The XLogP value of 6.8 indicates that Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester. Following Lipinski's Rule of Five, Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester?

The CAS number of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester is 10526-15-5.

What is the molecular formula of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester?

The molecular formula of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester is C22H42O4S.

What is the molecular weight of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester?

The molecular weight of Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester is 402.2804 g/mol.

Where can I buy Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester?

You can request a quote for Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester?

Yes, CoreyChem provides custom synthesis services for Propanoic acid, 3,3'-thiobis-, 1,1'-bis(2-ethylhexyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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