D-Alaninamide hydrochloride - ≥97% , CAS No.71810-97-4

CAS: 71810-97-4 Cat. No.: H589984 Molecular Weight: 124.57 EC Number: 692-007-6

GRADE & PURITY ≥97%

Synonyms

AM81484 | H-D-Ala-NH2 hydrochloride, AldrichCPR | (2R)-2-aminopropanamide hydrochloride | (2R)-2-amino-propanamide hydrochloride | D-ALA-NH2.HCL | (2R)-2-aminopropanamide;hydrochloride | DTXSID80379706 | FIAINKIUSZGVGX-HSHFZTNMSA-N | AS-18523 | A837335 |

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

Application：

D-Alaninamide hydrochloride is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals.

Specifications

Synonyms

AM81484 | H-D-Ala-NH2 hydrochloride, AldrichCPR | (2R)-2-aminopropanamide hydrochloride | (2R)-2-amino-propanamide hydrochloride | D-ALA-NH2.HCL | (2R)-2-aminopropanamide;hydrochloride | DTXSID80379706 | FIAINKIUSZGVGX-HSHFZTNMSA-N | AS-18523 | A837335 |

Specifications & Purity

≥97%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 504761916
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761916
• Canonical Smiles: CC(C(=O)N)N.Cl
• IUPAC Name: (2R)-2-aminopropanamide;hydrochloride
• InChIKey: FIAINKIUSZGVGX-HSHFZTNMSA-N
• INCHI: 1S/C3H8N2O.ClH/c1-2(4)3(5)6;/h2H,4H2,1H3,(H2,5,6);1H/t2-;/m1./s1
• Isomeric SMILES: C[C@H](C(=O)N)N.Cl
• Molecular Weight: 124.57
• Reaxy-Rn: 4753413
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4753413&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 Alpha amino acids and derivatives
            • Level7 Alpha amino acid amides

• 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: Alpha amino acid amides
• Alternative Parents: Alanine and derivatives Primary carboxylic acid amides Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid amide - Alanine or derivatives - Carboxamide group - Primary carboxylic acid amide - Organic oxygen compound - Hydrocarbon derivative - Hydrochloride - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Organic oxide - Organopnictogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
• 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

• Solubility: Soluble in 1% acetic acid and water.
• Molecular Weight: 124.570 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 124.04 Da
• Monoisotopic Mass: 124.04 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 61.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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

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