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Dihexyl ether structure
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Dihexyl ether

TL;DR: Dihexyl ether (CAS 112-58-3) is a chemical compound with molecular formula C12H26O and molecular weight 186.19836 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-hexoxyhexane

Also Known As: Dihexyl ether, Hexyl ether, dihexylether, N-Hexyl ether, 1-hexoxyhexane

CAS Number
112-58-3
Molecular Formula
C12H26O
Molecular Weight
186.19836 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (184 patents) Analytical Reagents (41 patents) Biotechnology (103 patents) Catalysts (127 patents) Coatings & Adhesives (685 patents)

Technical Specifications

Molecular FormulaC12H26O
Molecular Weight186.19836 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)9.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds10
Exact Mass186.19836 Da
Heavy Atoms13
Complexity71.0
Vapor Pressure0.04 [mmHg]
SMILESCCCCCCOCCCCCC
InChIKeyBPIUIOXAFBGMNB-UHFFFAOYSA-N

Product Description

Applications: Dihexyl ether is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A polymer intermediate supplied by CoreyChem, Dihexyl ether (CAS 112-58-3) has the molecular formula C12H26O and a molecular weight of 186.2 g/mol. Synonyms include Dihexyl ether and Hexyl ether.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Dihexyl ether

XLogP
4.7
TPSA (Topological Polar Surface Area)
9.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
10
Heavy Atoms
13
Complexity
71.0
Exact Mass
186.19836
Monoisotopic Mass
186.19836
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 Dihexyl ether

The XLogP value of 4.7 indicates that Dihexyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Dihexyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihexyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dihexyl ether?

The CAS number of Dihexyl ether is 112-58-3.

What is the molecular formula of Dihexyl ether?

The molecular formula of Dihexyl ether is C12H26O.

What is the molecular weight of Dihexyl ether?

The molecular weight of Dihexyl ether is 186.19836 g/mol.

What are the applications of Dihexyl ether?

Dihexyl ether is used in polymer chemistry and functional materials synthesis, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Dihexyl ether?

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

Does CoreyChem offer custom synthesis for Dihexyl ether?

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

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