1,2-Bis(phenylthio)ethane - ≥98%(GC) , CAS No.622-20-8

CAS: 622-20-8 Cat. No.: B152487 Formula: C₁₄H₁₄S₂ Peso molecolare: 246.39 Numero EC: 210-723-5

GRADE & PURITY ≥98%(GC)

Synonyms

([2-(Phenylsulfanyl)ethyl]sulfanyl)benzene # | {[2-(phenylsulfanyl)ethyl]sulfanyl}benzene | Bis(phenylthio)ethane, 1,2- | Benzene,1'-[1,2-ethanediylbis(thio)]bis- | 2-phenylsulfanylethylsulfanylbenzene | Ethane, 1,2-bis(phenylthio)- | MHCVYAFXPIMYRD-UHFFF

Storage

Room temperature

Shipped In

Normal

Panoramica

Product Application：
1,2-Bis(phenylthio)ethane, is used for the synthesis of the bismaleimide resin, APO-BMI, used in syntactic foams.

Specifications

Sinonimi

([2-(Phenylsulfanyl)ethyl]sulfanyl)benzene # | {[2-(phenylsulfanyl)ethyl]sulfanyl}benzene | Bis(phenylthio)ethane, 1,2- | Benzene,1'-[1,2-ethanediylbis(thio)]bis- | 2-phenylsulfanylethylsulfanylbenzene | Ethane, 1,2-bis(phenylthio)- | MHCVYAFXPIMYRD-UHFFF

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 488184288
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184288
• Sorrisi canonici: C1=CC=C(C=C1)SCCSC2=CC=CC=C2
• IUPAC Name: 2-phenylsulfanylethylsulfanylbenzene
• InChIKey: MHCVYAFXPIMYRD-UHFFFAOYSA-N
• INCHI: 1S/C14H14S2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h1-10H,11-12H2
• Isomeri SMILES: C1=CC=C(C=C1)SCCSC2=CC=CC=C2
• Peso molecolare: 246.39
• Reaxy-Rn: 1877719
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1877719&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Classe Thioethers
      • Subclass Aryl thioethers

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Classe: Thioethers
• Subclass: Aryl thioethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl thioethers
• Alternative Parents: Thiophenol ethers Alkylarylthioethers Benzene and substituted derivatives Sulfenyl compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aryl thioether - Thiophenol ether - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Sulfenyl compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by 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

Obiettivi associati (umani)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

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

KCNH2 Tclin HERG (29587 Activities)

Discover Target: KCNH2

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

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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

Mus musculus (284745 Activities)

Explore this target

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B16 (5829 Activities)

Explore this target

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

lef Anthrax lethal factor (7585 Activities)

Discover Target: lef

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

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

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

Rorc Nuclear receptor ROR-gamma (89407 Activities)

Discover Target: Rorc

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Insoluble in water
• Punto di ebollizione (°C): 65 °C/2 mmHg
• Punto di fusione (°C): 70 °C
• Peso molecolare: 246.400 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 246.054 Da
• Monoisotopic Mass: 246.054 Da
• Topological Polar Surface Area: 50.600 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 150.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 622-20-8, the molecular formula is C14H14S2, and the molecular weight is 246.39 g/mol. InChIKey MHCVYAFXPIMYRD-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.