Pyrene-d10 - ≥98 atom% D , CAS No.1718-52-1

CAS: 1718-52-1 Cat. No.: P118197 Fórmula: C₁₆D₁₀ Peso molecular: 212.31 Número CE: 623-338-6

GRADE & PURITY ≥98 atom% D

Synonyms

D98353 | Pyrene D10 | 1,2,3,4,5,6,7,8,9,10-decadeuteriopyrene | Pyrene-d10, analytical standard | Pyrene D10 10 microg/mL in Cyclohexane | Pyrene D10 500 microg/mL in Acetone | Pyrene-1,2,3,4,5,6,7,8,9,10-d10 | Pyrene-d10, 98 atom % D | Pyrene D10 100 mic

Storage

Protected from light,Room temperature

Shipped In

Normal

Visão geral

Environmental Analysis, Synthetic Intermediates, Polycyclic Aromatic Hydrocarbons (PAHs), Priority  Pollutants.

Specifications

Sinónimos

D98353 | Pyrene D10 | 1,2,3,4,5,6,7,8,9,10-decadeuteriopyrene | Pyrene-d10, analytical standard | Pyrene D10 10 microg/mL in Cyclohexane | Pyrene D10 500 microg/mL in Acetone | Pyrene-1,2,3,4,5,6,7,8,9,10-d10 | Pyrene-d10, 98 atom % D | Pyrene D10 100 mic

Especificações e pureza

≥98 atom% D

Condições de armazenamento de armazenamento

Protected from light,Room temperature

Enviado em

Normal

Pureza

≥98 atom% D

Nomes e identificadores

• Sorrisos canónicos: C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2
• IUPAC Name: 1,2,3,4,5,6,7,8,9,10-decadeuteriopyrene
• InChIKey: BBEAQIROQSPTKN-LHNTUAQVSA-N
• INCHI: 1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D
• SMILES isoméricas: [2H]C1=C(C2=C3C(=C1[2H])C(=C(C4=C(C(=C(C(=C43)C(=C2[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]
• WGK Alemanha: 3
• CAS alternativo: 129-00-0(unlabelled)
• Peso molecular: 212.31
• Reaxy-Rn: 1307225
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1307225&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Pyrenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Pyrenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrenes
• Alternative Parents: Phenanthrenes and derivatives Naphthalenes Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Pyrene - Phenanthrene - Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
• 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: Moisture sensitive；Light sensitive
• Ponto de fusão (°C): 145-148°C
• Peso molecular: 212.310 g/mol
• XLogP3: 4.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 212.141 Da
• Monoisotopic Mass: 212.141 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 217.000
• Isotope Atom Count: 10
• 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

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What is the isotopic enrichment of this product?

This product is isotopically enriched to ≥98 atom% deuterium. 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 room temperature, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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

The CAS Number is 1718-52-1, the molecular formula is C16D10, and the molecular weight is 212.31 g/mol. InChIKey BBEAQIROQSPTKN-LHNTUAQVSA-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.