Acid-PEG2-SS-PEG2-acid - ≥98% , CAS No.1807539-10-1

CAS: 1807539-10-1 Cat. No.: A595139 Molecular Weight: 386.5 PubChem CID: 91809454

GRADE & PURITY ≥98%

Synonyms

4,7,14,17-TETRAOXA-10,11-DITHIAICOSANEDIOIC ACID | 4,7,14,17-Tetraoxa-10,11-dithiaeicosanedioic acid | PD171215 | AKOS040741029 | HY-140112 | 1807539-10-1 | C70557 | MS-26388 | BP-22788 | Acid-PEG2-SS-PEG2-Acid | DTXSID501234279 | 3-[2-[2-[2-[2-(2-carboxy

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Acid-PEG2-SS-PEG2-acid is a cleavable PEG linker with carboxylic acid groups at both terminus. The disulfide bonds can be cleaved via a reduction reaction using Dithiothreitol (DTT) reagent. The terminal carboxylic acids can be reacted with primary amines in the presences of activators such as EDC and DCC to form stable amide bonds. The hydrophilic PEG linkers can increase the water solubility of the compound in aqueous media.

Specifications

Synonyms

4, 7, 14, 17-TETRAOXA-10, 11-DITHIAICOSANEDIOIC ACID | 4, 7, 14, 17-Tetraoxa-10, 11-dithiaeicosanedioic acid | PD171215 | AKOS040741029 | HY-140112 | 1807539-10-1 | C70557 | MS-26388 | BP-22788 | Acid-PEG2-SS-PEG2-Acid | DTXSID501234279 | 3-[2-[2-[2-[2-(2-carboxy

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: C(COCCOCCSSCCOCCOCCC(=O)O)C(=O)O
• IUPAC Name: 3-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethyldisulfanyl]ethoxy]ethoxy]propanoic acid
• InChIKey: TZKZHEPGHNBGKD-UHFFFAOYSA-N
• INCHI: 1S/C14H26O8S2/c15-13(16)1-3-19-5-7-21-9-11-23-24-12-10-22-8-6-20-4-2-14(17)18/h1-12H2,(H,15,16)(H,17,18)
• Isomeric SMILES: C(COCCOCCSSCCOCCOCCC(=O)O)C(=O)O
• PubChem CID: 91809454
• Molecular Weight: 386.5

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Dicarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Dialkyldisulfides Sulfenyl compounds Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Dialkyldisulfide - Organic disulfide - Sulfenyl compound - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
• 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

• Solubility: Solubility in Water, DMSO, DCM, DMF
• Molecular Weight: 386.500 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 19
• Exact Mass: 386.107 Da
• Monoisotopic Mass: 386.107 Da
• Topological Polar Surface Area: 162.000 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 287.000
• 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