Diethylene glycol（DEG） - ≥98%(GC) , CAS No.111-46-6

CAS: 111-46-6 Cat. No.: D110831 Formula: C₄H₁₀O₃ Peso molecolare: 106.12 Beilstein Registry Number: 969209 Numero EC: 203-872-2

GRADE & PURITY ≥98%(GC)

Synonyms

BIDD:ER0301 | DEG | HO(CH2)2O(CH2)2OH | PEG 200 | Diethylenglykol rein | Diglykol | EC 203-872-2 | beta,beta'-Dihydroxydiethyl ether | DIETHYLENE GLYCOL (USP-RS) | DIETHYLENE GLYCOL [INCI] | 2,2'-0xydiethanol | 3-Oxapentamethylene-1,5-diol | EINECS 203-87

Storage

Room temperature

Shipped In

Normal

Panoramica

Diethylene glycol (DEG) is formed as side reaction product during the esterification reaction of terephthalic acid with ethylene glycol.It readily forms complexes with 3d transition metal cations in the presence of alkaline hydroxide.Its solutions are widely employed for antifreezing and lubricating applications. Its degradation by oxidation methods using ozone and by modified Fenton process (mixture of hydrogen peroxide and ferric salt) has been described.
Diethylene glycol (diglycol) is used in biomaterials engineering to functionalize peptide nanofibers to improve their aggregation and proteolytic degradation properties. Diethylene glycol may be used as a solvent, reducing agent and derivatizing agent in the preparation of various types of nanoparticles.

Specifications

Sinonimi

BIDD:ER0301 | DEG | HO(CH2)2O(CH2)2OH | PEG 200 | Diethylenglykol rein | Diglykol | EC 203-872-2 | beta,beta'-Dihydroxydiethyl ether | DIETHYLENE GLYCOL (USP-RS) | DIETHYLENE GLYCOL [INCI] | 2,2'-0xydiethanol | 3-Oxapentamethylene-1,5-diol | EINECS 203-87

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

Pubchem Sid

508812037

Sorrisi canonici

C(COCCO)O

IUPAC Name

2-(2-hydroxyethoxy)ethanol

InChIKey

MTHSVFCYNBDYFN-UHFFFAOYSA-N

INCHI

1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2

Isomeri SMILES

C(COCCO)O

WGK Germania

1

RTECS

ID5950000

Peso molecolare

106.12

Beilstein

969209

Reaxy-Rn

969209

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=969209&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: hydroxyether

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

Obiettivi associati (umani)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NR1H4 Tclin Bile acid receptor FXR (6228 Activities)

Discover Target: NR1H4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Obiettivi associati (non umani)

Mapk1 MAP kinase ERK2 (650 Activities)

Discover Target: Mapk1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Miscible with water, insoluble in benzene, toluene, and carbon tetrachloride.
• Sensibilità: Moisture sensitive.
• Indice di rifrazione: 1.446-1.448
• Punto di infiammabilità (°F): 289℉
• Punto di infiammabilità (°C): 143℃
• Punto di ebollizione (°C): 245°C
• Punto di fusione (°C): -10°C
• Peso molecolare: 106.120 g/mol
• XLogP3: -1.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 106.063 Da
• Monoisotopic Mass: 106.063 Da
• Topological Polar Surface Area: 49.700 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 26.100
• 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