5-Ethyl-m-xylene - ≥98%(GC) , CAS No.934-74-7

CAS: 934-74-7 Cat. No.: E156311 Formula: C₁₀H₁₄ Peso molecolare: 134.22 Numero EC: 213-290-0

GRADE & PURITY ≥98%(GC)

Synonyms

5-Ethyl-m-xylene | LMAUULKNZLEMGN-UHFFFAOYSA-N | UNII-WQH822L3HK | m-Xylene, 5-ethyl- | E0282 | AKOS006228184 | 1,3-DIMETHYL-5-ETHYLBENZENE | DTXSID1061316 | 1,3-Dimethyl-5-ethyl benzene | 5-ethyl-1,3-dimethylbenzene | Q63409470 | Benzene,5-dimethyl- | Be

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

5-Ethyl-m-xylene | LMAUULKNZLEMGN-UHFFFAOYSA-N | UNII-WQH822L3HK | m-Xylene, 5-ethyl- | E0282 | AKOS006228184 | 1,3-DIMETHYL-5-ETHYLBENZENE | DTXSID1061316 | 1,3-Dimethyl-5-ethyl benzene | 5-ethyl-1,3-dimethylbenzene | Q63409470 | Benzene,5-dimethyl- | Be

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 508809839
• Sorrisi canonici: CCC1=CC(=CC(=C1)C)C
• IUPAC Name: 1-ethyl-3,5-dimethylbenzene
• InChIKey: LMAUULKNZLEMGN-UHFFFAOYSA-N
• INCHI: 1S/C10H14/c1-4-10-6-8(2)5-9(3)7-10/h5-7H,4H2,1-3H3
• Isomeri SMILES: CCC1=CC(=CC(=C1)C)C
• Peso molecolare: 134.22
• Reaxy-Rn: 2038360
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2038360&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Xylenes
• Intermediate Tree Nodes: Not available
• Direct Parent: m-Xylenes
• Alternative Parents: Aromatic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: M-xylene - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions.
• 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

• Indice di rifrazione: 1.50
• Punto di infiammabilità (°C): 38°C(lit.)
• Punto di ebollizione (°C): 184°C
• Punto di fusione (°C): -84°C(lit.)
• Peso molecolare: 134.220 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• 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: 86.200
• 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