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PEG-3 Distearate structure
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PEG-3 Distearate

TL;DR: PEG-3 Distearate (CAS 25062-49-1) is a chemical compound with molecular formula C42H82O6 and molecular weight 682.61115 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-(2-octadecanoyloxyethoxy)ethoxy]ethyl octadecanoate

Also Known As: PEG-3 Distearate, Triglycol distearate, CUTINA TS, PHOENATE 3 DSA, NIKKOL ESTEPEARL 30

CAS Number
25062-49-1
Molecular Formula
C42H82O6
Molecular Weight
682.61115 g/mol
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Application Areas

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

Coatings & Adhesives (1 patents) Organic Building Blocks (2 patents) Pharmaceutical Intermediates (2 patents)

Technical Specifications

Molecular FormulaC42H82O6
Molecular Weight682.61115 g/mol
XLogP16.5
Topological Polar Surface Area (TPSA)71.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds43
Exact Mass682.61115 Da
Heavy Atoms48
Complexity586.0
SMILESCCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCCCCCCCCCCCC
InChIKeyYBRJTUFWBLSLHY-UHFFFAOYSA-N

Chemical Property Profile of PEG-3 Distearate

XLogP
16.5
TPSA (Topological Polar Surface Area)
71.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
43
Heavy Atoms
48
Complexity
586.0
Exact Mass
682.61115
Monoisotopic Mass
682.61115
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 PEG-3 Distearate

The XLogP value of 16.5 indicates that PEG-3 Distearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for PEG-3 Distearate. Following Lipinski's Rule of Five, PEG-3 Distearate 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 PEG-3 Distearate?

The CAS number of PEG-3 Distearate is 25062-49-1.

What is the molecular formula of PEG-3 Distearate?

The molecular formula of PEG-3 Distearate is C42H82O6.

What is the molecular weight of PEG-3 Distearate?

The molecular weight of PEG-3 Distearate is 682.61115 g/mol.

Where can I buy PEG-3 Distearate?

You can request a quote for PEG-3 Distearate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for PEG-3 Distearate?

Yes, CoreyChem provides custom synthesis services for PEG-3 Distearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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