2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate

• Catalog Number: ACM9014851-1
• Product Name: 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate
• CAS: 9014-85-1
• Category: Polymer/Macromolecule
• Synonyms: 2,4,7,9-tetramethyl-5-decyne-4,7-diol, Acetylenol EL, 2,4,7,9-Tetramethyl-5-decyne-4,7-diol-ethylene oxide adduct
• IUPAC Name: ethane-1,2-diol;2,4,7,9-tetramethyldec-5-yne-4,7-diol
• Molecular Weight: 288.42g/mol
• Molecular Formula: (CH3)2CHCH2C(CH3)[(-OCH2CH2-)mOH]C≡CC(CH3)[(-OCH2CH2-)nOH]CH2CH(CH3)2
• Canonical SMILES: OCCO.CC(C)CC(C)(O)C#CC(C)(O)CC(C)C
• InChI: 1S/C14H26O2.C2H6O2/c1-11(2)9-13(5,15)7-8-14(6,16)10-12(3)4;3-1-2-4/h11-12,15-16H,9-10H2,1-6H3;3-4H,1-2H2
• InChI Key: SUHUKEQAOUOUJO-UHFFFAOYSA-N
• Boiling Point: >121 °C (lit.)
• Density: 1.04 g/mL at 25 °C
• Application: Surfactant.; Reduces surface tension; wetting agent, defoamer, and emulsifier for emulsion polymerization.
• Complexity: 262
• Covalently-Bonded Unit Count: 2
• EC Number: 500-022-5
• Exact Mass: 288.23006g/mol
• Features And Benefits: 1. High quality products; 2. Fast delivery; 3. Additional products can be ordered, please contact us for details
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 4
• Heavy Atom Count: 20
• MDL Number: MFCD00678776
• Monoisotopic Mass: 288.23006g/mol
• NACRES: NA.23
• Packaging: Packaging; 100 mL in poly bottle
• PubChem ID: 24869824
• Quality Level: 200
• Refractive Index: n20/D 1.468
• Rotatable Bond Count: 7

Custom Q&A

What is the molecular formula of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The molecular formula is C18H34O4.

What is the molecular weight of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The molecular weight is 314.5 g/mol.

What is the IUPAC name of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The IUPAC name is 2-[7-(2-hydroxyethoxy)-2,4,7,9-tetramethyldec-5-yn-4-yl]oxyethanol.

What is the InChI of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The InChI is InChI=1S/C18H34O4/c1-15(2)13-17(5,21-11-9-19)7-8-18(6,14-16(3)4)22-12-10-20/h15-16,19-20H,9-14H2,1-6H3.

What is the InChIKey of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The InChIKey is JIMHRFRMUJZRFD-UHFFFAOYSA-N.

What is the canonical SMILES of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The canonical SMILES is CC(C)CC(C)(C#CC(C)(CC(C)C)OCCO)OCCO.

What is the XLogP3-AA value of 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate?

The XLogP3-AA value is 2.4.

How many hydrogen bond donor counts does 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate have?

It has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate have?

It has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does 2,4,7,9-Tetramethyl-5-decyne-4,7-diol ethoxylate have?

It has 12 rotatable bond counts.