3-Allyloxypropionic Acid - ≥95%(GC) , CAS No.22577-15-7

CAS: 22577-15-7 Cat. No.: A151450 Formule: C₆H₁₀O₃ Poids moléculaire: 130.14 Numéro CE: 672-718-8

GRADE & PURITY ≥95%(GC)

Synonyms

3-Allyloxypropionic Acid | 3-Allyloxypropionic Acid, 95% | 3-prop-2-enoxypropanoic acid | XAA57715 | 3-(allyloxy)propionic acid | AKOS005202721 | MFCD00039537 | 3-(prop-2-en-1-yloxy)propanoic acid | 3-(Allyloxy)propanoic acid # | 3-(Allyloxy)propanoicacid

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonymes

3-Allyloxypropionic Acid | 3-Allyloxypropionic Acid, 95% | 3-prop-2-enoxypropanoic acid | XAA57715 | 3-(allyloxy)propionic acid | AKOS005202721 | MFCD00039537 | 3-(prop-2-en-1-yloxy)propanoic acid | 3-(Allyloxy)propanoic acid # | 3-(Allyloxy)propanoicacid

Spécifications et pureté

≥95%(GC)

Conditions de stockage de stockage

Store at 2-8°C

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%(GC)

Noms et identifiants

• Pubchem Sid: 508809010
• Sourires canoniques: C=CCOCCC(=O)O
• IUPAC Name: 3-prop-2-enoxypropanoic acid
• InChIKey: LBJZZFXUVYHXPH-UHFFFAOYSA-N
• INCHI: 1S/C6H10O3/c1-2-4-9-5-3-6(7)8/h2H,1,3-5H2,(H,7,8)
• Isomères SMILES: C=CCOCCC(=O)O
• Poids moléculaire: 130.14
• Reaxy-Rn: 1752348
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1752348&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: 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

Propriétés chimiques et physiques

• Sensibilité: heat sensitive
• Indice de réfraction: 1.44
• Point d'éclair (°C): 92 °C
• Point d'ébullition (°C): 192°C(lit.)
• Poids moléculaire: 130.139 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 130.063 Da
• Monoisotopic Mass: 130.063 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 98.500
• Isotope Atom Count: 0
• 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