1-Propanol-d₈ - ≥98 atom% D,≥99%, used for Environmental monitoring applications - Quality control reference standards - Advanced materials research and development - Analytical method development various applications , CAS No.61393-63-3

CAS: 61393-63-3 Cat. No.: P472030 Fórmula: C₃D₈O Peso molecular: 68.14 Número EC: 685-793-7

GRADE & PURITY ≥98 atom% D,≥99%

Synonyms

D98824 | Deuterated propyl alcohol | AKOS015912469 | (~2~H_7_)Propan-1-(~2~H)ol | DTXSID30583977 | 1-Propanol-d8, 98 atom % D | 1,1,1,2,2,3,3-heptadeuterio-3-deuteriooxypropane | 1-Propanol-d8 | Deuterated Propanol

Storage

Protected from light,Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Descripción general

1-Propanol-d8 98 atom % D is a high-purity isotope product with a unique chemical profile that belongs to the class of isotopes.

Specifications

Sinónimos

D98824 | Deuterated propyl alcohol | AKOS015912469 | (~2~H_7_)Propan-1-(~2~H)ol | DTXSID30583977 | 1-Propanol-d8, 98 atom % D | 1,1,1,2,2,3,3-heptadeuterio-3-deuteriooxypropane | 1-Propanol-d8 | Deuterated Propanol

Especificaciones y pureza

≥98 atom% D,≥99%

Aplicación

Environmental monitoring applications - Quality control reference standards - Advanced materials research and development - Analytical method development

Condiciones de almacenamiento de almacenamiento

Protected from light,Store at -20°C,Desiccated

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98 atom% D,≥99%

Nombres e identificadores

• Sonrisas canónicas: CCCO
• IUPAC Name: 1,1,1,2,2,3,3-heptadeuterio-3-deuteriooxypropane
• InChIKey: BDERNNFJNOPAEC-RIZALVEQSA-N
• INCHI: 1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3/i1D3,2D2,3D2,4D
• Isómeros SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])O[2H]
• CAS alternativo: 71-23-8（unlabelled）
• Número ONU: 1274
• Peso molecular: 68.14

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Primary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
• 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

Propiedades químicas y físicas

• Sensibilidad: Light & Moisture Sensitive
• Índice de refracción: n20/D 1.384 (lit.)
• Punto de inflamación (°F): 71.6 °F - closed cup
• Punto de inflamación (°C): 22 °C - closed cup
• Punto de ebullición (°C): 97℃ (lit.)
• Punto de fusión (°C): −127℃ (lit.)
• Peso molecular: 68.140 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 68.1077 Da
• Monoisotopic Mass: 68.1077 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 7.200
• Isotope Atom Count: 8
• 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