2-{1-[(tert-butoxy)carbonyl]-2-methylazetidin-3-yl}acetic acid - ≥97% , CAS No.2167195-25-5

CAS: 2167195-25-5 Cat. No.: A631880 Molecular Weight: 229.28 PubChem CID: 135393115

GRADE & PURITY ≥97%

Synonyms

2167195-25-5 | 2-{1-[(tert-butoxy)carbonyl]-2-methylazetidin-3-yl}acetic acid | 2-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]acetic acid | MFCD31537388 | AS-78557 | 2-(1-Boc-2-methylazetidin-3-yl)acetic acid | P19727 | 2-{1-[(t-Butoxy)car

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2167195-25-5 | 2-{1-[(tert-butoxy)carbonyl]-2-methylazetidin-3-yl}acetic acid | 2-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]acetic acid | MFCD31537388 | AS-78557 | 2-(1-Boc-2-methylazetidin-3-yl)acetic acid | P19727 | 2-{1-[(t-Butoxy)car

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1C(CN1C(=O)OC(C)(C)C)CC(=O)O
• IUPAC Name: 2-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]acetic acid
• InChIKey: CTVQRDMZEJXDTO-UHFFFAOYSA-N
• INCHI: 1S/C11H19NO4/c1-7-8(5-9(13)14)6-12(7)10(15)16-11(2,3)4/h7-8H,5-6H2,1-4H3,(H,13,14)
• PubChem CID: 135393115
• Molecular Weight: 229.28

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azetidines
      • Subclass Azetidinecarboxylic acids or derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azetidines
• Subclass: Azetidinecarboxylic acids or derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Azetidinecarboxylic acids
• Alternative Parents: Methyl-branched fatty acids Heterocyclic fatty acids Carbamate esters Organic carbonic acids and derivatives Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Methyl-branched fatty acid - Heterocyclic fatty acid - Branched fatty acid - Azetidinecarboxylic acid - Fatty acyl - Fatty acid - Carbamic acid ester - Carbonic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as azetidinecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an azetidine 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