Nonane - Anhydrous Grade, ≥99% , CAS No.111-84-2

CAS: 111-84-2 Cat. No.: N119711 Fórmula: C₉H₂₀ Peso molecular: 128.26 Beilstein Registry Number: 1(4)447 Número EC: 203-913-4

CALIDAD & PUREZA Anhydrous Grade, ≥99%

Synonyms

MFCD02099450 | Shellsol 140 | Lodyne S | NCGC00091787-01 | n-C9H20 | NSC72430 | NSC-72430 | CH3-[CH2]7-CH3 | DTXCID005796 | NONANE [HSDB] | CHEBI:32892 | HSDB 107 | Iotrochotin | NONANE MFC9 H20 | n-nonane-d20 | C8F3CAB9-DAF5-4085-84EB-07C0AB04D3A1 | Non

Storage

Room temperature

Shipped In

FedEx DG Service

Especificaciones

Sinónimos

MFCD02099450 | Shellsol 140 | Lodyne S | NCGC00091787-01 | n-C9H20 | NSC72430 | NSC-72430 | CH3-[CH2]7-CH3 | DTXCID005796 | NONANE [HSDB] | CHEBI:32892 | HSDB 107 | Iotrochotin | NONANE MFC9 H20 | n-nonane-d20 | C8F3CAB9-DAF5-4085-84EB-07C0AB04D3A1 | Non

Especificaciones y pureza

Anhydrous Grade, ≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

FedEx DG Service

Grado

Anhydrous Grade

Pureza

≥99%

Nombres e identificadores

Pubchem Sid

528772320

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528772320

Sonrisas canónicas

CCCCCCCCC

IUPAC Name

nonane

InChIKey

BKIMMITUMNQMOS-UHFFFAOYSA-N

INCHI

1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3

Isómeros SMILES

CCCCCCCCC

RTECS

RA6115000

Número ONU

1920

Grupo de embalaje

III

Peso molecular

128.26

Beilstein

1(4)447

Reaxy-Rn

1696917

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1696917&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: 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
• Descripción: 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: a small molecule

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

Objetivos asociados (humanos)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

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

Lymphoblastoid cell (5959 Activities)

Explore this target

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

Objetivos asociados (no humanos)

Rattus norvegicus (775804 Activities)

Explore this target

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: It is miscible with acetone, benzene, chloroform and heptane, soluble in ethanol and ether, insoluble in water.
• Índice de refracción: 1.4
• Punto de inflamación (°F): 87.8 °F
• Punto de inflamación (°C): 31°C(lit.)
• Punto de ebullición (°C): 151°C
• Punto de fusión (°C): -53°C
• Peso molecular: 128.250 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 128.157 Da
• Monoisotopic Mass: 128.157 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 33.300
• 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