(2S)-2-amino-2-(4,4-difluorocyclohexyl)acetic acid;hydrochloride - ≥97% , CAS No.2231665-41-9

CAS: 2231665-41-9 Cat. No.: A632322 PubChem CID: 69348515

GRADE & PURITY ≥97%

Synonyms

2231665-41-9 | (S)-2-Amino-2-(4,4-difluorocyclohexyl)acetic acid hydrochloride | (2S)-2-amino-2-(4,4-difluorocyclohexyl)acetic acid | hydrochloride | (2S)-2-AMINO-2-(4,4-DIFLUOROCYCLOHEXYL)ACETIC ACID HCL | (2S)-2-amino-2-(4,4-difluorocyclohexyl)acetic ac

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

2231665-41-9 | (S)-2-Amino-2-(4, 4-difluorocyclohexyl)acetic acid hydrochloride | (2S)-2-amino-2-(4, 4-difluorocyclohexyl)acetic acid | hydrochloride | (2S)-2-AMINO-2-(4, 4-DIFLUOROCYCLOHEXYL)ACETIC ACID HCL | (2S)-2-amino-2-(4, 4-difluorocyclohexyl)acetic ac

Specifications & Purity

≥97%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1CC(CCC1C(C(=O)O)N)(F)F.Cl
• IUPAC Name: (2S)-2-amino-2-(4,4-difluorocyclohexyl)acetic acid;hydrochloride
• InChIKey: YLJOKBLTFFPVBF-RGMNGODLSA-N
• INCHI: 1S/C8H13F2NO2.ClH/c9-8(10)3-1-5(2-4-8)6(11)7(12)13;/h5-6H,1-4,11H2,(H,12,13);1H/t6-;/m0./s1
• Isomeric SMILES: C1CC(CCC1[C@@H](C(=O)O)N)(F)F.Cl
• PubChem CID: 69348515

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Halogenated fatty acids Cyclohexyl halides Branched fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organooxygen compounds Organofluorides Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Cyclohexyl halide - Halogenated fatty acid - Branched fatty acid - Fatty acyl - Fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• 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