ácido (R)-(+)-2-acetoxipropiónico - ≥95% , CAS No.18668-00-3

CAS: 18668-00-3 Cat. No.: R405630 Peso molecular: 132.12 Número EC: 834-678-1

GRADE & PURITY ≥95%

Synonyms

Propanoic acid,2-(acetyloxy)-,(2R)- | Propanoic acid, 2-(acetyloxy)-, (2R)- | (R)-2-acetoxypropanoic acid | MFCD16036178 | (R)-(+)-2-Acetoxypropionic Acid | AS-63232 | (2R)-2-acetyloxypropanoic acid | SCHEMBL1764859 | T70471 | (+)-O-Acetyl-D-lactic Acid |

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Specifications

Sinónimos

Propanoic acid, 2-(acetyloxy)-, (2R)- | Propanoic acid, 2-(acetyloxy)-, (2R)- | (R)-2-acetoxypropanoic acid | MFCD16036178 | (R)-(+)-2-Acetoxypropionic Acid | AS-63232 | (2R)-2-acetyloxypropanoic acid | SCHEMBL1764859 | T70471 | (+)-O-Acetyl-D-lactic Acid |

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504763620
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763620
• Sonrisas canónicas: CC(C(=O)O)OC(=O)C
• IUPAC Name: (2R)-2-acetyloxypropanoic acid
• InChIKey: WTLNOANVTIKPEE-GSVOUGTGSA-N
• INCHI: 1S/C5H8O4/c1-3(5(7)8)9-4(2)6/h3H,1-2H3,(H,7,8)/t3-/m1/s1
• Isómeros SMILES: C[C@H](C(=O)O)OC(=O)C
• Peso molecular: 132.12
• Reaxy-Rn: 1722938
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1722938&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Carboxylic acid esters Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Carboxylic acid ester - 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 dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Heat Sensitive
• Índice de refracción: 1.42
• Rotación específica [α]: 9° (C=2.5,1.5mol/L NaOH)
• Punto de inflamación (°C): 95 °C
• Punto de ebullición (°C): 82 °C/0.2 mmHg
• Peso molecular: 132.110 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 132.042 Da
• Monoisotopic Mass: 132.042 Da
• Topological Polar Surface Area: 63.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 129.000
• 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