Decanenitrile - ≥98%(GC) , CAS No.1975-78-6

CAS: 1975-78-6 Cat. No.: D154472 Formula: C₁₀H₁₉N Peso molecolare: 153.27 Beilstein Registry Number: 2(4)1051 Numero EC: 217-830-6

GRADE & PURITY ≥98%(GC)

Synonyms

UNII-1602VQ5IVC | D2426 | DTXSID9027449 | 1602VQ5IVC | Decanonitrile | Q27251754 | 1-Cyanononane | NSC6085 | NSC-6085 | ethoxycarbohydrazide | Caprinitrile | EN300-7500553 | NSC 6085 | n-Decanenitrile | 1-Decanenitrile | 3-Thiahexane | NCGC00248853-01 | E

Storage

Room temperature

Shipped In

Normal

Panoramica

Decanonitrile, an organic compound with a nitrile group, plays a vital role in organic synthesis. The nitrile group is highly polar, making it a good electrophilic center. It can participate in nucleophilic attack, often serving as a key intermediate in the formation of other functional groups such as ketones, carboxylic acids, and amines. Additionally, decanonitrile acts as a precursor in the production of polyamides.

Specifications

Sinonimi

UNII-1602VQ5IVC | D2426 | DTXSID9027449 | 1602VQ5IVC | Decanonitrile | Q27251754 | 1-Cyanononane | NSC6085 | NSC-6085 | ethoxycarbohydrazide | Caprinitrile | EN300-7500553 | NSC 6085 | n-Decanenitrile | 1-Decanenitrile | 3-Thiahexane | NCGC00248853-01 | E

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 488184979
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184979
• Sorrisi canonici: CCCCCCCCCC#N
• IUPAC Name: decanenitrile
• InChIKey: HBZDPWBWBJMYRY-UHFFFAOYSA-N
• INCHI: 1S/C10H19N/c1-2-3-4-5-6-7-8-9-10-11/h2-9H2,1H3
• Isomeri SMILES: CCCCCCCCCC#N
• Peso molecolare: 153.27
• Beilstein: 2(4)1051
• Reaxy-Rn: 1750910
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1750910&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Organic cyanides

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Organic cyanides
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitriles
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
• 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: 1.4290 to 1.4310
• Punto di infiammabilità (°C): 97°C
• Punto di ebollizione (°C): 237°C
• Punto di fusione (°C): -15°C
• Peso molecolare: 153.260 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 153.152 Da
• Monoisotopic Mass: 153.152 Da
• Topological Polar Surface Area: 23.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 109.000
• 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