(S)-(-)-2-Bromopropionic acid - ≥98% , CAS No.32644-15-8

CAS: 32644-15-8 Cat. No.: B106080 Fórmula: C₃H₅BrO₂ Peso molecular: 152.97 Beilstein Registry Number: 1720261 Número EC: 628-991-0

GRADE & PURITY ≥98%

Synonyms

(S)-(-)-2-Bromopropionic acid | (S)-()-2-Bromopropionic acid | MONMFXREYOKQTI-REOHCLBHSA-N | MFCD00137325 | (S)-ALPHA-BROMOPROPIONIC ACID | (S)-(-)-2-Bromopropionic acid, 99% | (S)-2-bromopropionic acid | (s)-2-bromo-propionic acid | (2S)-2-bromopropanoic

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Used for the direct enantiomeric assay of carboxylic acids by proton NMR.

Specifications

Sinónimos

(S)-(-)-2-Bromopropionic acid | (S)-()-2-Bromopropionic acid | MONMFXREYOKQTI-REOHCLBHSA-N | MFCD00137325 | (S)-ALPHA-BROMOPROPIONIC ACID | (S)-(-)-2-Bromopropionic acid, 99% | (S)-2-bromopropionic acid | (s)-2-bromo-propionic acid | (2S)-2-bromopropanoic

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 508806761
• Sonrisas canónicas: CC(C(=O)O)Br
• IUPAC Name: (2S)-2-bromopropanoic acid
• InChIKey: MONMFXREYOKQTI-REOHCLBHSA-N
• INCHI: 1S/C3H5BrO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)/t2-/m0/s1
• Isómeros SMILES: C[C@@H](C(=O)O)Br
• WGK Alemania: 3
• Número ONU: 3265
• Peso molecular: 152.97
• Beilstein: 1720261
• Reaxy-Rn: 605451
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605451&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Alpha-halocarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Alpha-halocarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Alpha-halocarboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-halocarboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha-halocarboxylic acids. These are carboxylic acids containing a halogen atom bonded to the alpha carbon atom.
• 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: Light sensitive.
• Índice de refracción: 1.47
• Rotación específica [α]: -27 ° (neat)
• Punto de inflamación (°F): 215.6 °F
• Punto de inflamación (°C): 100 °C
• Punto de ebullición (°C): 78°C
• Punto de fusión (°C): -35°C
• Peso molecular: 152.970 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 151.947 Da
• Monoisotopic Mass: 151.947 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 61.800
• 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