3,4-Ethylenedioxythiophene(EDOT) - electronic grade, ≥99.9%, Moisture content ≤ 0.1% , CAS No.126213-50-1

CAS: 126213-50-1 Cat. No.: E1520163 분자식: C₆H₆O₂S 분자량: 142.18 EC 번호: 603-128-0

GRADE & PURITY Electronic grade, ≥99.9%, Moisture content ≤ 0.1%

Synonyms

2,3-Dihydrothieno[3,4-b][1,4]dioxine

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

동의어

2,3-Dihydrothieno[3,4-b][1,4]dioxine

사양 및 순도

electronic grade, ≥99.9%, Moisture content ≤ 0.1%

보관 조건

Store at 2-8°C

배송

Wet ice

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등급

전자용 등급

순수함

≥99.9%

이름과 식별자

• 정식 스마일: C1COC2=CSC=C2O1
• IUPAC Name: 2,3-dihydrothieno[3,4-b][1,4]dioxine
• InChIKey: GKWLILHTTGWKLQ-UHFFFAOYSA-N
• INCHI: 1S/C6H6O2S/c1-2-8-6-4-9-3-5(6)7-1/h3-4H,1-2H2
• 이성체 SMILES: C1COC2=CSC=C2O1
• WGK 독일: 2
• UN 번호: 2810
• 분자량: 142.18
• Reaxy-Rn: 7126466
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7126466&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Para dioxins Thiophenes Heteroaromatic compounds Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Alkyl aryl ether - Para-dioxin - Heteroaromatic compound - Thiophene - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
• 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

화학 및 물리적 특성

• 용해성: Slightly soluble in water
• 감도: Heat Sensitive;Moisture sensitive
• 굴절률: 1.58
• 발화점(°F): 219℉
• 발화점(°C): 104°C
• 끓는점(°C): 112°C/20mmHg
• 녹는점(°C): 10 °C
• 분자량: 142.180 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 142.009 Da
• Monoisotopic Mass: 142.009 Da
• Topological Polar Surface Area: 46.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 95.200
• 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