Propionic Acid-d5 - ≥98 atom% D,≥98% , CAS No.60153-92-6

CAS: 60153-92-6 Cat. No.: P343294 Fórmula: C₃HD₅O₂ Peso molecular: 79.11 Número EC: 685-184-6

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

d5-propanoic acid | DTXSID60731121 | A935650 | Propionic-d5 acid | Propanoic-d5 acid | Propionic Acid-d5 | Propionic-d5 acid, >=98 atom % D, >=99% (CP) | (~2~H_5_)Propanoic acid | D99193 | (?H?)propanoic acid | 2,2,3,3,3-pentadeuteriopropanoic acid | Etha

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Descripción general

Hyperpolarization, Metabolomics, MRI/MRS, MS/MS Standards, Synthetic Intermediates

Specifications

Sinónimos

d5-propanoic acid | DTXSID60731121 | A935650 | Propionic-d5 acid | Propanoic-d5 acid | Propionic Acid-d5 | Propionic-d5 acid, >=98 atom % D, >=99% (CP) | (~2~H_5_)Propanoic acid | D99193 | (?H?)propanoic acid | 2,2,3,3,3-pentadeuteriopropanoic acid | Etha

Especificaciones y pureza

≥98 atom% D,≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light,Room temperature,Argon charged

Enviado en

Normal

Pureza

≥98 atom% D,≥98%

Nombres e identificadores

• Pubchem Sid: 504771720
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504771720
• Sonrisas canónicas: CCC(=O)O
• IUPAC Name: 2,2,3,3,3-pentadeuteriopropanoic acid
• InChIKey: XBDQKXXYIPTUBI-ZBJDZAJPSA-N
• INCHI: 1S/C3H6O2/c1-2-3(4)5/h2H2,1H3,(H,4,5)/i1D3,2D2
• Isómeros SMILES: [2H]C([2H])([2H])C([2H])([2H])C(=O)O
• CAS alternativo: 79-09-4(unlabelled)
• Peso molecular: 79.11
• Reaxy-Rn: 506071
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506071&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
• 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: Moisture &light sensitive
• Peso molecular: 79.110 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 79.0682 Da
• Monoisotopic Mass: 79.0682 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 40.200
• Isotope Atom Count: 5
• 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

Referencias

1. Haiyin Zhang, Haofang Wan, Yihang Lu, Yu He, Haitong Wan, Chang Li.  (2026)  Astragalus membranaceus—Salvia miltiorrhiza Decoction Ameliorates Metabolic Syndrome and Gut Microbiota Dysbiosis Induced by High‐Fat Diet: A Comparative Study.  Food Science & Nutrition,  14  (1): (e71436).  [PMID:41523274] [10.1002/fsn3.71436]