[1-¹³C]glycolaldehyde - ≥99%, Aqueous solution ~0.206 M , CAS No.71122-42-4

CAS: 71122-42-4 Cat. No.: C338941 Summenformel: C¹³CH₄O₂ Molekulargewicht: 61.04

GRADE & PURITY ≥99%, Aqueous solution ~0.206 M

Synonyms

[1-13C]GLYCOLALDEHYDE | 2-Hydroxyacetaldehyde-1-13C | DTXSID00724572 | Hydroxy(1-13C)acetaldehyde | HY-146995S | Hydroxy(1-~13~C)acetaldehyde | Glycolaldehyde-1-13C

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

[1-13C]GLYCOLALDEHYDE | 2-Hydroxyacetaldehyde-1-13C | DTXSID00724572 | Hydroxy(1-13C)acetaldehyde | HY-146995S | Hydroxy(1-~13~C)acetaldehyde | Glycolaldehyde-1-13C

Spezifikationen & Reinheit

≥99%, Aqueous solution ~0.206 M

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥99%

Namen und Kennungen

• Kanonisches Lächeln: C(C=O)O
• IUPAC Name: 2-hydroxyacetaldehyde
• InChIKey: WGCNASOHLSPBMP-OUBTZVSYSA-N
• INCHI: 1S/C2H4O2/c3-1-2-4/h1,4H,2H2/i1+1
• Isomere SMILES: C([13CH]=O)O
• Alternative CAS-Nummer: 478529-69-0
• Molekulargewicht: 61.04
• Reaxy-Rn: 506029
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506029&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Carbonyl compounds
        • Ebene5 Aldehydes
          • Ebene6 Short-chain aldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Short-chain aldehydes
• Alternative Parents: Primary alcohols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic oxide - Hydrocarbon derivative - Short-chain aldehyde - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as short-chain aldehydes. These are an aldehyde with a chain length containing between 2 and 5 carbon atoms.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water.
• Brechungsindex: n20D1.38 (Predicted)
• Molekulargewicht: 61.045 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 61.0245 Da
• Monoisotopic Mass: 61.0245 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 18.000
• 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