Ethylene glycol butyl ether(EB) - Standard for GC, ≥99.5%(GC) , CAS No.111-76-2

CAS: 111-76-2 Cat. No.: E110823 Fórmula: C₆H₁₄O₂ Peso molecular: 118.17 Beilstein Registry Number: 1732511 Número CE: 203-905-0

GRADE & PURITY Standard for GC, ≥99.5%(GC)

Synonyms

Caswell No. 121 | Monobutyl ether of ethylene glycol | Ether monobutylique de l'ethyleneglycol | 2-Butossi-etanolo | 2-BUTOXYETHANOL [IARC] | AI3-0993 | Butylglycol [French,German] | CAS-111-76-2 | Ethylene glycol mono butyl ether | BUTOXYETHANOL [INCI] |

Storage

Room temperature

Shipped In

FedEx DG Service

Visão geral

It has a moderate ether-like odor. It is soluble in 20 times its own volume of water, as well as in alcohols, most organic solvents, and mineral oils. It exhibits a high dilution ratio with petroleum hydrocarbons. Primarily used as a solvent for nitrocellulose, lacquers, fast-drying paints, varnishes, enamel, and paint strippers. Additionally, it serves as a fiber wetting agent, pesticide dispersant, resin plasticizer, and organic synthesis intermediate. It is also employed as a reagent for determining iron and molybdenum, as well as an auxiliary solvent for improving emulsification performance and dissolving mineral oils in soap solutions.

Specifications

Sinónimos

Caswell No. 121 | Monobutyl ether of ethylene glycol | Ether monobutylique de l'ethyleneglycol | 2-Butossi-etanolo | 2-BUTOXYETHANOL [IARC] | AI3-0993 | Butylglycol [French,German] | CAS-111-76-2 | Ethylene glycol mono butyl ether | BUTOXYETHANOL [INCI] |

Especificações e pureza

Standard for GC, ≥99.5%(GC)

Condições de armazenamento de armazenamento

Room temperature

Enviado em

FedEx DG Service

Grau

Standard for GC

Pureza

≥99.5%(GC)

Nomes e identificadores

Pubchem Sid

528769328

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528769328

Sorrisos canónicos

CCCCOCCO

IUPAC Name

2-butoxyethanol

InChIKey

POAOYUHQDCAZBD-UHFFFAOYSA-N

INCHI

1S/C6H14O2/c1-2-3-5-8-6-4-7/h7H,2-6H2,1H3

SMILES isoméricas

CCCCOCCO

WGK Alemanha

1

RTECS

KJ8575000

Número UN

2810

Grupo de embalagem

III

Peso molecular

118.17

Beilstein

1732511

Reaxy-Rn

1732511

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732511&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
• Descrição: 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: ether - primary alcohol

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

Alvos associados (humanos)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

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

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

Lymphoblastoid cell (5959 Activities)

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Skin (286 Activities)

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Alvos associados (não humanos)

Oryctolagus cuniculus (11301 Activities)

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

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in most organic solvents such as water, ethanol, and ether.
• Sensibilidade: Moisture sensitive.
• Índice de refração: 1.4198
• Ponto de inflamação (°C): 61.1℃
• Ponto de ebulição (°C): 171°C
• Ponto de fusão (°C): -75°C
• Peso molecular: 118.170 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 118.099 Da
• Monoisotopic Mass: 118.099 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 37.500
• 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