TERGITOL™ - MIN-FOAM 1X , CAS No.68439-51-0

CAS: 68439-51-0 Cat. No.: T486492 EC Number: 614-484-1

GRADE & PURITY MIN-FOAM 1X

Synonyms

Butan-1-ol;ethane-1,2-diol;propane-1,2-diol | PAGMBE | Tergitol(R) | U-2000 | TERGITOL(TM), MIN FOAM 1x | Ucon(TM) HTF 14, 18-260 C range of application | QMNOIORHZMRPLS-UHFFFAOYSA-N | BCP31133

Storage

Room temperature

Overview

Tergitol is a nonionic surfactant which can be used to extract estrogensTergitol has been used in a study to assess a method for detectingSalmonella entericaserovar Enteritidis in liquid whole eggs using loop-mediated isothermal amplification (LAMP). It has also been used in a study to investigate the oxidation of nonylphenol ethoxylates (NPEO) and octylphenol ethoxylates (OPEO) by oxidant systems generating hydroxide radicals.

Specifications

Synonyms

Butan-1-ol;ethane-1, 2-diol;propane-1, 2-diol | PAGMBE | Tergitol(R) | U-2000 | TERGITOL(TM), MIN FOAM 1x | Ucon(TM) HTF 14, 18-260 C range of application | QMNOIORHZMRPLS-UHFFFAOYSA-N | BCP31133

Specifications & Purity

MIN-FOAM 1X

Legal Information

TERGITOL is a trademark of The Dow Chemical Company ("Dow") or an affiliated company of Dow

Storage

Room temperature

Note

Polyglycol ether (nonionic) surfactants.', '

Names and Identifiers

• Canonical Smiles: CCCCO.CC(CO)O.C(CO)O
• IUPAC Name: butan-1-ol;ethane-1,2-diol;propane-1,2-diol
• InChIKey: QMNOIORHZMRPLS-UHFFFAOYSA-N
• INCHI: 1S/C4H10O.C3H8O2.C2H6O2/c1-2-3-4-5;1-3(5)2-4;3-1-2-4/h5H,2-4H2,1H3;3-5H,2H2,1H3;3-4H,1-2H2

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Secondary alcohol - Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Molecular Weight: 212.280 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 212.162 Da
• Monoisotopic Mass: 212.162 Da
• Topological Polar Surface Area: 101.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 40.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3