tert-butyl (2S,6S)-2,6-dimethyl-3-oxo-piperazine-1-carboxylate - ≥97% , CAS No.2306247-05-0

CAS: 2306247-05-0 Cat. No.: T635803 Molecular Weight: 228.29 PubChem CID: 154804785

GRADE & PURITY ≥97%

Synonyms

2306247-05-0 | tert-butyl (2S,6S)-2,6-dimethyl-3-oxo-piperazine-1-carboxylate | tert-Butyl (2S,6S)-2,6-dimethyl-3-oxopiperazine-1-carboxylate | t-Butyl (2S,6S)-2,6-dimethyl-3-oxo-piperazine-1-carboxylate | starbld0027597 | MFCD31925523 | AS-79485 | P20278

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2306247-05-0 | tert-butyl (2S, 6S)-2, 6-dimethyl-3-oxo-piperazine-1-carboxylate | tert-Butyl (2S, 6S)-2, 6-dimethyl-3-oxopiperazine-1-carboxylate | t-Butyl (2S, 6S)-2, 6-dimethyl-3-oxo-piperazine-1-carboxylate | starbld0027597 | MFCD31925523 | AS-79485 | P20278

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1CNC(=O)C(N1C(=O)OC(C)(C)C)C
• IUPAC Name: tert-butyl (2S,6S)-2,6-dimethyl-3-oxopiperazine-1-carboxylate
• InChIKey: DIUMEULIRBZIBH-YUMQZZPRSA-N
• INCHI: 1S/C11H20N2O3/c1-7-6-12-9(14)8(2)13(7)10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,14)/t7-,8-/m0/s1
• PubChem CID: 154804785
• Molecular Weight: 228.29

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
            • Level7 Alanine 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 - Alpha amino acids and derivatives
• Direct Parent: Alanine and derivatives
• Alternative Parents: Piperazine carboxylic acids Carbamate esters Organic carbonic acids and derivatives Lactams Carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alanine or derivatives - Piperazine-1-carboxylic acid - Piperazine - 1,4-diazinane - Carbamic acid ester - Carbonic acid derivative - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - 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 alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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