Undecane - Standard for GC, ≥99.5%(GC) , CAS No.1120-21-4

CAS: 1120-21-4 Cat. No.: U108239 Formule: C₁₁H₂₄ Poids moléculaire: 156.31 Numéro CE: 214-300-6

GRADE & PURITY Standard for GC, ≥99.5%(GC)

Synonyms

UNDECANE, N- | AI3-21126 | CCRIS 3796 | Undekan | DTXSID9021689 | MFCD00008959 | EC 214-300-6 | NSC 66159 | N-UNDECANE [HSDB] | CAS-1120-21-4 | n-Hendecane | Q150731 | NCGC00254001-01 | LS-14030 | undecan | CHEBI:46342 | UNDECANE [INCI] | NCGC00247896-01

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

UNDECANE, N- | AI3-21126 | CCRIS 3796 | Undekan | DTXSID9021689 | MFCD00008959 | EC 214-300-6 | NSC 66159 | N-UNDECANE [HSDB] | CAS-1120-21-4 | n-Hendecane | Q150731 | NCGC00254001-01 | LS-14030 | undecan | CHEBI:46342 | UNDECANE [INCI] | NCGC00247896-01

Spécifications et pureté

Standard for GC, ≥99.5%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Grade

Standard for GC

Pureté

≥99.5%(GC)

Noms et identifiants

Pubchem Sid

508812531

Sourires canoniques

CCCCCCCCCCC

IUPAC Name

undecane

InChIKey

RSJKGSCJYJTIGS-UHFFFAOYSA-N

INCHI

1S/C11H24/c1-3-5-7-9-11-10-8-6-4-2/h3-11H2,1-2H3

Isomères SMILES

CCCCCCCCCCC

Numéro ONU

2330

Groupe d'emballage

III

Poids moléculaire

156.31

Reaxy-Rn

1697099

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697099&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Classe Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• External Descriptors: an alkane

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

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Insoluble in water, miscible in alcohol and ether.
• Indice de réfraction: 1.42
• Point d'éclair (°C): 62°C
• Point d'ébullition (°C): 195°C
• Point de fusion (°C): -26°C
• Poids moléculaire: 156.310 g/mol
• XLogP3: 5.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 8
• Exact Mass: 156.188 Da
• Monoisotopic Mass: 156.188 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 49.100
• 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