Benzene solution - analytical standard, 1000ug/ml in carbon disulfide , CAS No.71-43-2

CAS: 71-43-2 Cat. No.: B117361 Summenformel: C₆H₆ Molekulargewicht: 78.11 Beilstein Registry Number: 969212 EG-Nummer: 200-753-7

GRADE & PURITY Analytical standard, 1000ug/ml in carbon disulfide

Synonyms

benzene|benzol|71-43-2|Cyclohexatriene|benzole|Pyrobenzole|Benzine|Benzen|Coal naphtha|Pyrobenzol|Mineral naphtha|Phene|Phenyl hydride|Benzolene|Bicarburet of hydrogen|Motor benzol|Benzeen|Benzin|Benzolo|Fenzen|[6]Annulene|Nitration benzene|(6)Annulene|Be

Storage

Room temperature,Argon charged,Desiccated,Cool

Shipped In

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Specifications

Synonyme

benzene | benzol | 71-43-2 | Cyclohexatriene | benzole | Pyrobenzole | Benzine | Benzen | Coal naphtha | Pyrobenzol | Mineral naphtha | Phene | Phenyl hydride | Benzolene | Bicarburet of hydrogen | Motor benzol | Benzeen | Benzin | Benzolo | Fenzen | [6]Annulene | Nitration benzene | (6)Annulene | Be

Spezifikationen & Reinheit

analytical standard, 1000ug/ml in carbon disulfide

Storage

Room temperature,Argon charged,Desiccated,Cool

Verschickt in

FedEx DG Service

Note

Analytischer Standard

Namen und Kennungen

Kanonisches Lächeln

C1=CC=CC=C1

IUPAC Name

benzene

InChIKey

UHOVQNZJYSORNB-UHFFFAOYSA-N

INCHI

1S/C6H6/c1-2-4-6-5-3-1/h1-6H

Isomere SMILES

C1=CC=CC=C1

WGK Deutschland

3

RTECS

CY1400000

UN-Nummer

1114

Verpackungsgruppe

II

Molekulargewicht

78.11

Beilstein

969212

Reaxy-Rn

969212

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=969212&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Aromatic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• External Descriptors: an aromatic compound

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

Zugehörige Ziele (menschlich)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

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RXRA Tclin Retinoid X receptor alpha (3637 Activities)

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TP53 Tchem Cellular tumor antigen p53 (48468 Activities)

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Ppard Peroxisome proliferator-activated receptor delta (358 Activities)

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

E Lysozyme (95 Activities)

Discover Target: E

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Hygroscopic.
• Brechungsindex: 1.50108
• Flammpunkt (°C): -11℃
• Siedepunkt (°C): 80.1°C
• Schmelzpunkt (°C): 5.5°C
• Molekulargewicht: 78.110 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 78.047 Da
• Monoisotopic Mass: 78.047 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 15.500
• 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