m-PEG5-Ms - ≥98% , CAS No.130955-37-2

CAS: 130955-37-2 Cat. No.: M596830 Molecular Weight: 286.3 PubChem CID: 14763679

GRADE & PURITY ≥98%

Synonyms

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate | C70304 | HY-130457 | m-PEG5-Ms | DTXSID101219106 | BP-23516 | GXMYCEJMFZMVSC-UHFFFAOYSA-N | m-PEG4-OMs | 2,5,8,11-Tetraoxatridecan-13-ol, 13-methanesulfonate | SCHEMBL661478 | 2,5,8,11-tetrao

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Application

227,228,229

Overview

m-PEG5-Ms is a PEG derivative containing a mesyl group. The mesyl group is a good leaving group for nucleophilic substitution reactions. The hydrophilic PEG spacer increases solubility in aqueous media.

Specifications

Synonyms

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate | C70304 | HY-130457 | m-PEG5-Ms | DTXSID101219106 | BP-23516 | GXMYCEJMFZMVSC-UHFFFAOYSA-N | m-PEG4-OMs | 2, 5, 8, 11-Tetraoxatridecan-13-ol, 13-methanesulfonate | SCHEMBL661478 | 2, 5, 8, 11-tetrao

Specifications & Purity

≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: COCCOCCOCCOCCOS(=O)(=O)C
• IUPAC Name: 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate
• InChIKey: GXMYCEJMFZMVSC-UHFFFAOYSA-N
• INCHI: 1S/C10H22O7S/c1-13-3-4-14-5-6-15-7-8-16-9-10-17-18(2,11)12/h3-10H2,1-2H3
• Isomeric SMILES: COCCOCCOCCOCCOS(=O)(=O)C
• Alternate CAS: 130955-37-2
• PubChem CID: 14763679
• Molecular Weight: 286.3

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonic acid esters
• Alternative Parents: Sulfonic acid esters Sulfonyls Methanesulfonates Dialkyl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organosulfonic acid ester - Sulfonic acid ester - Sulfonyl - Methanesulfonate - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organosulfonic acid esters. These are esters of sulfonic acid, which have the general structure RS(=O)2OR' (R,R' = organyl, not H).
• 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: 286.340 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 13
• Exact Mass: 286.109 Da
• Monoisotopic Mass: 286.109 Da
• Topological Polar Surface Area: 88.700 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 260.000
• 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: 1