1,3-dietilbenzene - ≥97%(GC) , CAS No.141-93-5

CAS: 141-93-5 Cat. No.: D155005 Formula: C₁₀H₁₄ Peso molecolare: 134.22 Numero EC: 205-511-4

GRADE & PURITY ≥97%(GC)

Synonyms

DTXCID402003 | Benzene,3-dietil- | WLN: 2R C2 | D0478 | NCGC00356969-01 | 1,3-DIETHYLBENZENE [HSDB] | m-dietilbenzene | NSC 62102 | 1,3-dietilbenzene-d14 | Q24816743 | Benzene,m-dietil- | ZM2X7I1G8Y | Benzene,1,3-dietil- | InChI=1/C10H14/c1-3-9-6-

Storage

Room temperature

Shipped In

Normale

Panoramica

gli 1,3-dietilbenzeni sono idrocarburi aromatici classificati nella classe dei composti organici volatili (COV).

Specifications

Sinonimi

DTXCID402003 | Benzene,3-dietil- | WLN: 2R C2 | D0478 | NCGC00356969-01 | 1,3-DIETHYLBENZENE [HSDB] | m-dietilbenzene | NSC 62102 | 1,3-dietilbenzene-d14 | Q24816743 | Benzene,m-dietil- | ZM2X7I1G8Y | Benzene,1,3-dietil- | InChI=1/C10H14/c1-3-9-6-

Specifiche e purezza

≥97%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normale

Purezza

≥97%(GC)

Nomi e identificatori

• Pubchem Sid: 504751753
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751753
• Sorrisi canonici: CCC1=CC(=CC=C1)CC
• IUPAC Name: 1,3-diethylbenzene
• InChIKey: AFZZYIJIWUTJFO-UHFFFAOYSA-N
• INCHI: 1S/C10H14/c1-3-9-6-5-7-10(4-2)8-9/h5-8H,3-4H2,1-2H3
• Isomeri SMILES: CCC1=CC(=CC=C1)CC
• WGK Germania: 3
• RTECS: CZ5620000
• Numero UN: 2049
• Gruppo di imballaggio: III
• Peso molecolare: 134.22
• Reaxy-Rn: 1903394
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1903394&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Descrizione: 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: 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

Proprietà chimiche e fisiche

• Solubilità: Miscible with ethanol, benzene, carbon tetrachloride, ethyl ether and acetone. Immiscible with water and diethylbenzene.
• Indice di rifrazione: 1.496
• Punto di infiammabilità (°F): 131 °F
• Punto di infiammabilità (°C): 55 °C
• Punto di ebollizione (°C): 182°C
• Punto di fusione (°C): -84°C(lit.)
• Peso molecolare: 134.220 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 134.11 Da
• Monoisotopic Mass: 134.11 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 76.000
• 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 ≥97% 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 is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

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

The CAS Number is 141-93-5, the molecular formula is C10H14, and the molecular weight is 134.22 g/mol. InChIKey AFZZYIJIWUTJFO-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.