DL-Arginine monohydrochloride monohydrate - ≥98% , CAS No.332360-01-7

CAS: 332360-01-7 Cat. No.: D351356 Molecular Weight: 228.69 PubChem CID: 2734011

GRADE & PURITY ≥98%

Synonyms

dl-arginine hydrochloride monohydrate | Dl-Arginine Hydrochloride Hydrate | 2-Amino-5-guanidinopentanoic acid hydrochloride hydrate | AKOS015895731 | 2-amino-5-guanidino-pentanoic acid hydrate hydrochloride | 4-Isoxazolecarboxylic acid, 5-(bromomethyl)-3-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

dl-arginine hydrochloride monohydrate | Dl-Arginine Hydrochloride Hydrate | 2-Amino-5-guanidinopentanoic acid hydrochloride hydrate | AKOS015895731 | 2-amino-5-guanidino-pentanoic acid hydrate hydrochloride | 4-Isoxazolecarboxylic acid, 5-(bromomethyl)-3-

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488192470
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192470
• Canonical Smiles: C(CC(C(=O)O)N)CN=C(N)N.O.Cl
• IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid;hydrate;hydrochloride
• InChIKey: NUFCANQNMWVENN-UHFFFAOYSA-N
• INCHI: 1S/C6H14N4O2.ClH.H2O/c7-4(5(11)12)2-1-3-10-6(8)9;;/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);1H;1H2
• Isomeric SMILES: C(CC(C(=O)O)N)CN=C(N)N.O.Cl
• PubChem CID: 2734011
• Molecular Weight: 228.69

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 acids

• 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 acids
• Alternative Parents: Fatty acids and conjugates Guanidines Amino acids Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Fatty acid - Guanidine - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonyl group - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organopnictogen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• 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

• Molecular Weight: 228.680 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 228.099 Da
• Monoisotopic Mass: 228.099 Da
• Topological Polar Surface Area: 129.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 176.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

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