(1S,2S)-2-Aminocyclohexanol - ≥98% , CAS No.74111-21-0

CAS: 74111-21-0 Cat. No.: S304528 Peso molecular: 115.17 Número EC: 625-678-0

GRADE & PURITY ≥98%

Synonyms

AM62775 | (1S,2S)-2-AMINOCYCLOHEXANOL | (1S,2S)-2-amino-cyclohexanol | (1S,2S)-2-aminocyclohexan-1-ol | A850184 | Cyclohexanol,2-amino-,trans- | (1S,2S)-2-hydroxycyclohexylamine | 2-Aminocyclohexanol, (E)- | Cyclohexanol, 2-amino-, (1S,2S)- | DS-12884 | E

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

AM62775 | (1S, 2S)-2-AMINOCYCLOHEXANOL | (1S, 2S)-2-amino-cyclohexanol | (1S, 2S)-2-aminocyclohexan-1-ol | A850184 | Cyclohexanol, 2-amino-, trans- | (1S, 2S)-2-hydroxycyclohexylamine | 2-Aminocyclohexanol, (E)- | Cyclohexanol, 2-amino-, (1S, 2S)- | DS-12884 | E

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

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: 504764693
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764693
• Sonrisas canónicas: C1CCC(C(C1)N)O
• IUPAC Name: (1S,2S)-2-aminocyclohexan-1-ol
• InChIKey: PQMCFTMVQORYJC-WDSKDSINSA-N
• INCHI: 1S/C6H13NO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4,7H2/t5-,6-/m0/s1
• Isómeros SMILES: C1CC[C@@H]([C@H](C1)N)O
• Peso molecular: 115.17
• Reaxy-Rn: 2203206
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2203206&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Alcohols and polyols
        • Level5 Secondary alcohols
          • Level6 Cyclohexanols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Secondary alcohols
• Direct Parent: Cyclohexanols
• Alternative Parents: Cyclohexylamines Cyclic alcohols and derivatives 1,2-aminoalcohols Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - Cyclohexanol - Cyclic alcohol - 1,2-aminoalcohol - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as cyclohexanols. These are compounds containing an alcohol group attached to a cyclohexane ring.
• 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

• Punto de ebullición (°C): 201.1°C
• Punto de fusión (°C): 92-94°C
• Peso molecular: 115.170 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 115.1 Da
• Monoisotopic Mass: 115.1 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.900
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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