3-Aminocyclopentanecarboxylic acid - ≥95% , CAS No.89614-96-0

CAS: 89614-96-0 Cat. No.: A187884 Peso molecular: 129.2

GRADE & PURITY ≥95%

Synonyms

3-Aminocyclopentanecarboxylic acid | 3-amino-cyclopentanecarboxylic acid | cis-3-Aminocyclopentanecarboxylic acid | CAS_124355 | J-511687 | AKOS013154323 | DTXSID00328433 | EN300-94964 | SB12440 | cis-3-Amino-cyclopentanecarboxylic acid | METHDILAZINEHYDR

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

3-Aminocyclopentanecarboxylic acid | 3-amino-cyclopentanecarboxylic acid | cis-3-Aminocyclopentanecarboxylic acid | CAS_124355 | J-511687 | AKOS013154323 | DTXSID00328433 | EN300-94964 | SB12440 | cis-3-Amino-cyclopentanecarboxylic acid | METHDILAZINEHYDR

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 488189690
• Sonrisas canónicas: C1CC(CC1C(=O)O)N
• IUPAC Name: 3-aminocyclopentane-1-carboxylic acid
• InChIKey: MLLSSTJTARJLHK-UHFFFAOYSA-N
• INCHI: 1S/C6H11NO2/c7-5-2-1-4(3-5)6(8)9/h4-5H,1-3,7H2,(H,8,9)
• Isómeros SMILES: C1CC(CC1C(=O)O)N
• Peso molecular: 129.2
• Reaxy-Rn: 2828428
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2828428&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Gamma amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Gamma amino acids and derivatives
• Alternative Parents: Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Gamma amino acid or derivatives - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma 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

• Punto de ebullición (°C): 264.7°C
• Peso molecular: 129.160 g/mol
• XLogP3: -2.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 129.079 Da
• Monoisotopic Mass: 129.079 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 124.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1