D-Valinol - ≥98% , CAS No.4276-09-9

CAS: 4276-09-9 Cat. No.: V118431 Peso molecular: 103.16 Beilstein Registry Number: 1719138 Número EC: 922-908-4 PubChem CID: 6950587

GRADE & PURITY ≥98%

Synonyms

(2R)-2-amino-3-methyl-1-butanol | EN300-98065 | (-)-2-amino-3-methyl-1-butanol | AS-12364 | Q-200023 | (2R)-2-amino-3-methylbutan-1-ol | HY-30167 | (R)-valinol | 1-Butanol, 2-amino-3-methyl-, (2R)- | Valinol, D- | (1R)-1-Isopropyl-2-hydroxyethylamine | (R

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

(2R)-2-amino-3-methyl-1-butanol | EN300-98065 | (-)-2-amino-3-methyl-1-butanol | AS-12364 | Q-200023 | (2R)-2-amino-3-methylbutan-1-ol | HY-30167 | (R)-valinol | 1-Butanol, 2-amino-3-methyl-, (2R)- | Valinol, D- | (1R)-1-Isopropyl-2-hydroxyethylamine | (R

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: 488195904
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488195904
• Sonrisas canónicas: CC(C)C(CO)N
• IUPAC Name: (2R)-2-amino-3-methylbutan-1-ol
• InChIKey: NWYYWIJOWOLJNR-YFKPBYRVSA-N
• INCHI: 1S/C5H13NO/c1-4(2)5(6)3-7/h4-5,7H,3,6H2,1-2H3/t5-/m0/s1
• Isómeros SMILES: CC(C)[C@H](CO)N
• WGK Alemania: 3
• PubChem CID: 6950587
• Peso molecular: 103.16
• Beilstein: 1719138
• Reaxy-Rn: 1719138

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Primary alcohols Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 1,2-aminoalcohol - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 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: Air sensitive
• Índice de refracción: 1.455
• Rotación específica [α]: -18 ° (C=10, EtOH)
• Punto de inflamación (°F): 172.4 °F
• Punto de inflamación (°C): 78°C
• Punto de ebullición (°C): 189-190°C
• Punto de fusión (°C): 32-36°C
• Peso molecular: 103.160 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 103.1 Da
• Monoisotopic Mass: 103.1 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 45.300
• 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

Referencias

1. Lilan Tan, Wenrong Cai, Fangqin Wang, Junyao Li, Datong Wu, Yong Kong.  (2024)  Postsynthetic Modification Strategy for Constructing Electrochemiluminescence-Active Chiral Covalent Organic Frameworks Performing Efficient Enantioselective Sensing.  ANALYTICAL CHEMISTRY,      [PMID:38394220] [10.1021/acs.analchem.3c05887]