1-(4-bromopyrazol-1-yl)cyclopropanecarboxylic acid - ≥97% , CAS No.1935387-65-7

CAS: 1935387-65-7 Cat. No.: C631193 Molecular Weight: 231.05 EC Number: 847-355-5 PubChem CID: 131082594

GRADE & PURITY ≥97%

Synonyms

1-(4-bromopyrazol-1-yl)cyclopropanecarboxylic acid | EN300-261241 | PS-15901 | AKOS034066032 | 1-(4-bromo-1H-pyrazol-1-yl)cyclopropane-1-carboxylicacid | 1-(4-bromo-1H-pyrazol-1-yl)cyclopropane-1-carboxylic acid | 1935387-65-7 | 1-(4-bromopyrazol-1-yl)cyc

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1-(4-bromopyrazol-1-yl)cyclopropanecarboxylic acid | EN300-261241 | PS-15901 | AKOS034066032 | 1-(4-bromo-1H-pyrazol-1-yl)cyclopropane-1-carboxylicacid | 1-(4-bromo-1H-pyrazol-1-yl)cyclopropane-1-carboxylic acid | 1935387-65-7 | 1-(4-bromopyrazol-1-yl)cyc

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1CC1(C(=O)O)N2C=C(C=N2)Br
• IUPAC Name: 1-(4-bromopyrazol-1-yl)cyclopropane-1-carboxylic acid
• InChIKey: LHKYHZMGLXYIEV-UHFFFAOYSA-N
• INCHI: 1S/C7H7BrN2O2/c8-5-3-9-10(4-5)7(1-2-7)6(11)12/h3-4H,1-2H2,(H,11,12)
• Isomeric SMILES: C1CC1(C(=O)O)N2C=C(C=N2)Br
• Alternate CAS: 1935387-65-7
• PubChem CID: 131082594
• Molecular Weight: 231.05

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: Cyclopropanecarboxylic acids Aryl bromides Pyrazoles Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Cyclopropanecarboxylic acid or derivatives - Cyclopropanecarboxylic acid - Aryl halide - Aryl bromide - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Aromatic 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