1-(Aminomethyl)cyclopropanecarboxylic acid hydrochlorid - ≥95% , CAS No.1421601-23-1

CAS: 1421601-23-1 Cat. No.: A483335 Molecular Weight: 151.59 EC Number: 865-979-6

GRADE & PURITY ≥95%

Synonyms

1-(AMINOMETHYL)CYCLOPROPANECARBOXYLICACIDHYDROCHLORIDE | 1-Aminomethyl-cyclopropanecarboxylic acid x HCl | WGC60123 | 1-(AMINOMETHYL)CYCLOPROPANECARBOXYLIC ACID HYDROCHLORIDE | 1-(aminomethyl)cyclopropane-1-carboxylic acid hydrochloride | 1421601-23-1 | 1

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Synonyms

1-(AMINOMETHYL)CYCLOPROPANECARBOXYLICACIDHYDROCHLORIDE | 1-Aminomethyl-cyclopropanecarboxylic acid x HCl | WGC60123 | 1-(AMINOMETHYL)CYCLOPROPANECARBOXYLIC ACID HYDROCHLORIDE | 1-(aminomethyl)cyclopropane-1-carboxylic acid hydrochloride | 1421601-23-1 | 1

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Protected from light

Shipped In

Wet ice

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

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488201631
• Canonical Smiles: C1CC1(CN)C(=O)O.Cl
• IUPAC Name: 1-(aminomethyl)cyclopropane-1-carboxylic acid;hydrochloride
• InChIKey: SRTXENKRXZLJHQ-UHFFFAOYSA-N
• INCHI: 1S/C5H9NO2.ClH/c6-3-5(1-2-5)4(7)8;/h1-3,6H2,(H,7,8);1H
• Isomeric SMILES: C1CC1(CN)C(=O)O.Cl
• Molecular Weight: 151.59
• Reaxy-Rn: 26505637
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=26505637&ln=

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 Beta 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: Beta amino acids and derivatives
• Alternative Parents: Cyclopropanecarboxylic acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Beta amino acid or derivatives - Cyclopropanecarboxylic acid - Cyclopropanecarboxylic acid or derivatives - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
• 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

Chemical and Physical Properties

• Sensitivity: light sensitive
• Molecular Weight: 151.590 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 151.04 Da
• Monoisotopic Mass: 151.04 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 118.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3