Bis[2-(2-butoxyethoxy)ethyl]adipate

• CAS: 141-17-3
• Catalog Number: ACM141173
• Category: Polymer/Macromolecule
• Molecular Weight: 434.56
• Molecular Formula: C₂₂H₄₂O₈
• Synonyms: Adipic acid, bis(2-(2-butoxyethoxy)ethyl) ester;adipicacid,bis(2-(2-butoxyethoxy)ethyl)ester;adipicacidbis(diethyleneglycolmonobutylether)ester;bis(diethyleneglycolmonobutylether)adipate;Bis[2-(2-butoxyethoxy)ethyl] hexanedioate;bisoflex111;hexanedioicaci
• IUPAC Name: bis[2-(2-butoxyethoxy)ethyl] hexanedioate
• Canonical SMILES: CCCCOCCOCCOC(=O)CCCCC(=O)OCCOCCOCCCC
• InChI Key: SCABKEBYDRTODC-UHFFFAOYSA-N
• Boiling Point: 491.5ºC at 760 mmHg
• Melting Point: -11ºC(lit.)
• Flash Point: >230 °F
• Density: 1.01 g/mL at 25ºC(lit.)
• EC Number: 205-465-5
• Exact Mass: 434.28800
• H-Bond Acceptor: 8
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The molecular formula is C22H42O8.

When was the PubChem CID for Bis[2-(2-butoxyethoxy)ethyl]adipate created and modified?

It was created on 2005-03-27 and modified on 2023-12-02.

What is the IUPAC name of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The IUPAC name is bis[2-(2-butoxyethoxy)ethyl] hexanedioate.

What is the InChIKey for Bis[2-(2-butoxyethoxy)ethyl]adipate?

The InChIKey is SCABKEBYDRTODC-UHFFFAOYSA-N.

What is the Canonical SMILES for Bis[2-(2-butoxyethoxy)ethyl]adipate?

The Canonical SMILES are CCCCOCCOCCOC(=O)CCCCC(=O)OCCOCCOCCCC.

What is the molecular weight of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The molecular weight is 434.6 g/mol.

What is the XLogP3-AA value of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The XLogP3-AA value is 2.5.

How many hydrogen bond acceptors are there in Bis[2-(2-butoxyethoxy)ethyl]adipate?

There are 8 hydrogen bond acceptors.

What is the rotatable bond count of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The rotatable bond count is 25.

What is the topological polar surface area of Bis[2-(2-butoxyethoxy)ethyl]adipate?

The topological polar surface area is 89.5Ų.