Acetonitrile-¹⁵N - ≥98%,≥98 atom% ¹⁵N , CAS No.14149-39-4

CAS: 14149-39-4 Cat. No.: A471840 Fórmula: CH₃C¹⁵N Peso molecular: 42.05 Número CE: 687-093-7

GRADE & PURITY ≥98%,≥98 atom% ¹⁵N

Synonyms

Methyl cyanide-15N | (15N)acetonitrile | acetonitrile(15N) | 乙酰腈-15N

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Sinónimos

Methyl cyanide-15N | (15N)acetonitrile | acetonitrile(15N) | 乙酰腈-15N

Especificações e pureza

≥98%,≥98 atom% ¹⁵N

Condições de armazenamento de armazenamento

Store at 2-8°C,Protected from light

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%,≥98 atom% ¹⁵N

Nomes e identificadores

Sorrisos canónicos

CC#[15N]

IUPAC Name

acetonitrile

InChIKey

WEVYAHXRMPXWCK-LBPDFUHNSA-N

INCHI

1S/C2H3N/c1-2-3/h1H3/i3+1

SMILES isoméricas

CC#[15N]

CAS alternativo

75-05-8（unlabelled）

Número UN

1648

Peso molecular

42.05

Reaxy-Rn

2036405

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2036405&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
• Descrição: 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

Propriedades químicas e físicas

• Sensibilidade: Light sensitive；Moisture sensitive
• Índice de refração: n20/D 1.344 (lit.)
• Ponto de inflamação (°F): 42.8 °F - closed cup
• Ponto de inflamação (°C): 6 °C - closed cup
• Ponto de ebulição (°C): 81-82℃ (lit.)
• Ponto de fusão (°C): −48℃ (lit.)
• Peso molecular: 42.050 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 42.0236 Da
• Monoisotopic Mass: 42.0236 Da
• Topological Polar Surface Area: 23.800 Ų
• Heavy Atom Count: 3
• Formal Charge: 0
• Complexity: 29.300
• Isotope Atom Count: 1
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). This product is isotopically enriched to ≥98 atom% nitrogen-15. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 14149-39-4, the molecular formula is CH3C15N, and the molecular weight is 42.05 g/mol. InChIKey WEVYAHXRMPXWCK-LBPDFUHNSA-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.