Bis-PEG3-acid - ≥97% , CAS No.96517-92-9

CAS: 96517-92-9 Cat. No.: B412699 Peso molecular: 250.25

GRADE & PURITY ≥97%

Synonyms

3,3'-((Oxybis(ethane-2,1-diyl))bis(oxy))dipropanoic acid | 4,7,10-Trioxatridecanedioic acid

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Application

Antibody Drug Conjugates(ADC), Drug Delivery, Surface Modification, PEGylation of Protein, Peptide & Oligo

Descripción general

Information

Bis-PEG3-acid is a PEG-based PROTAC linker that is applicable to the synthesis of PROTACs.

Specifications

Sinónimos

3, 3'-((Oxybis(ethane-2, 1-diyl))bis(oxy))dipropanoic acid | 4, 7, 10-Trioxatridecanedioic acid

Especificaciones y pureza

≥97%

Mecanismos bioquímicos y fisiológicos

Bis-PEG3-acid is a PEG-based PROTAC linker that is applicable to the synthesis of PROTACs.

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C(COCCOCCOCCC(=O)O)C(=O)O
• IUPAC Name: 3-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]propanoic acid
• InChIKey: WFLUHYUKINZPNZ-UHFFFAOYSA-N
• INCHI: 1S/C10H18O7/c11-9(12)1-3-15-5-7-17-8-6-16-4-2-10(13)14/h1-8H2,(H,11,12)(H,13,14)
• Isómeros SMILES: C(COCCOCCOCCC(=O)O)C(=O)O
• Peso molecular: 250.25
• Reaxy-Rn: 1795159
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1795159&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Solubilidad: Solubility (25°C) In vitro
• Sensibilidad: light sensitive
• Peso molecular: 250.250 g/mol
• XLogP3: -1.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 12
• Exact Mass: 250.105 Da
• Monoisotopic Mass: 250.105 Da
• Topological Polar Surface Area: 102.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 195.000
• 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