Tyloxapol - BioReagent , CAS No.25301-02-4

CAS: 25301-02-4 Cat. No.: T755645 Formula: (C₁₅H₂₁O(C₂H₄O)m)n Molecular Weight: 261.38 (monomer) EC Number: 684-193-2

GRADE & PURITY BioReagent

Storage

Room temperature

Shipped In

Normal

Overview

Tyloxapol is a biocompatible surfactant

A nonionic liquid polymer of the alkyl aryl polyether alcohol type. Used as a surfactant.

Application:

Tyloxapol has been used in a study to assess the enhanced pulmonary absorption of recombinant human insulin. It has also been used in a study to investigate the metabolic pathways promoting intrahepatic fatty acid accumulation in methionine and choline deficiency.

Specifications

Specifications & Purity

BioReagent

Storage

Room temperature

Shipped In

Normal

Grade

BioReagent

Names and Identifiers

Pubchem Sid

528771026

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528771026

Canonical Smiles

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1

IUPAC Name

formaldehyde;oxirane;4-(2,4,4-trimethylpentan-2-yl)phenol

InChIKey

MDYZKJNTKZIUSK-UHFFFAOYSA-N

INCHI

1S/C14H22O.C2H4O.CH2O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11;1-2-3-1;1-2/h6-9,15H,10H2,1-5H3;1-2H2;1H2

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1

WGK Germany

2

RTECS

SM9750000

Molecular Weight

261.38 (monomer)

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbonyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbonyl compounds
• Alternative Parents: Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Organic oxide - Hydrocarbon derivative - Carbonyl group - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as carbonyl compounds. These are organic compounds containing a carbonyl group, with the general structure RC(=O)R', where R=organyl, R'=H, N, O, organyl group or halide group.
• 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

• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113°C
• Molecular Weight: 280.400 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 280.204 Da
• Monoisotopic Mass: 280.204 Da
• Topological Polar Surface Area: 49.800 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 204.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3