(S)-lactaldehyde - 1 M in H2O , CAS No.3913-64-2

CAS: 3913-64-2 Cat. No.: S1311312 Formule: C₃H₆O₂ Poids moléculaire: 74.08

GRADE & PURITY 1 M in H2O

Storage

Room temperature

Specifications

Spécifications et pureté

1 M in H2O

Conditions de stockage de stockage

Room temperature

Noms et identifiants

• Sourires canoniques: C[C@@H](C=O)O
• IUPAC Name: (2S)-2-hydroxypropanal
• InChIKey: BSABBBMNWQWLLU-VKHMYHEASA-N
• INCHI: 1S/C3H6O2/c1-3(5)2-4/h2-3,5H,1H3/t3-/m0/s1
• Poids moléculaire: 74.08

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Alpha-hydroxyaldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Alpha-hydroxyaldehydes
• Alternative Parents: Secondary alcohols Short-chain aldehydes Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-hydroxyaldehyde - Secondary alcohol - Organic oxide - Hydrocarbon derivative - Short-chain aldehyde - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha-hydroxyaldehydes. These are organic compounds containing an aldehyde substituted with a hydroxyl group on the adjacent carbon.
• External Descriptors: lactaldehyde

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

Propriétés chimiques et physiques

• Poids moléculaire: 74.080 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 74.0368 Da
• Monoisotopic Mass: 74.0368 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 33.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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

Foire aux questions

How should this product be stored?

Store at room temperature.

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

The CAS Number is 3913-64-2, the molecular formula is C3H6O2, and the molecular weight is 74.08 g/mol. InChIKey BSABBBMNWQWLLU-VKHMYHEASA-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.