(2S)-1-[(tert-butoxy)carbonyl]-3,3-dimethylazetidine-2-carboxylic acid - ≥97% , CAS No.1932195-22-6

CAS: 1932195-22-6 Cat. No.: D631087 Molecular Weight: 229.28 PubChem CID: 99963369

GRADE & PURITY ≥97%

Synonyms

1932195-22-6 | (2S)-1-[(tert-butoxy)carbonyl]-3,3-dimethylazetidine-2-carboxylic acid | (S)-1-(tert-Butoxycarbonyl)-3,3-dimethylazetidine-2-carboxylic acid | AKOS040768319 | D75230 | (2S)-1-[(tert-butoxy)carbonyl]-3,3-dimethylazetidine-2-carboxylicacid |

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1932195-22-6 | (2S)-1-[(tert-butoxy)carbonyl]-3, 3-dimethylazetidine-2-carboxylic acid | (S)-1-(tert-Butoxycarbonyl)-3, 3-dimethylazetidine-2-carboxylic acid | AKOS040768319 | D75230 | (2S)-1-[(tert-butoxy)carbonyl]-3, 3-dimethylazetidine-2-carboxylicacid |

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1(CN(C1C(=O)O)C(=O)OC(C)(C)C)C
• IUPAC Name: (2S)-3,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-2-carboxylic acid
• InChIKey: CZHREJZYTWIJKW-SSDOTTSWSA-N
• INCHI: 1S/C11H19NO4/c1-10(2,3)16-9(15)12-6-11(4,5)7(12)8(13)14/h7H,6H2,1-5H3,(H,13,14)/t7-/m1/s1
• Isomeric SMILES: CC1(CN([C@@H]1C(=O)O)C(=O)OC(C)(C)C)C
• PubChem CID: 99963369
• Molecular Weight: 229.28

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: Azetidinecarboxylic acids Carbamate esters Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Azetidinecarboxylic acid - Carbamic acid ester - Azetidine - Carboxylic acid - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aliphatic heteromonocyclic 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