DL-Lysine Dihydrochloride - ≥98%(T) , CAS No.617-68-5

CAS: 617-68-5 Cat. No.: S161260 Molecular Weight: 219.11 PubChem CID: 517175

GRADE & PURITY ≥98%(T)

Synonyms

1J3H6DC5PT | AKOS015845556 | SR-01000075724-6 | D91253 | MFCD00066389 | SCHEMBL1191963 | FT-0703743 | 2,6-diaminohexanoic acid dihydrochloride | L-LYSINE 2HCL (6-13C) | DL-Lysine (dihydrochloride) | Lysine--hydrogen chloride (1/2) | Lysine, dihydrochlorid

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

1J3H6DC5PT | AKOS015845556 | SR-01000075724-6 | D91253 | MFCD00066389 | SCHEMBL1191963 | FT-0703743 | 2, 6-diaminohexanoic acid dihydrochloride | L-LYSINE 2HCL (6-13C) | DL-Lysine (dihydrochloride) | Lysine--hydrogen chloride (1/2) | Lysine, dihydrochlorid

Specifications & Purity

≥98%(T)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%(T)

Names and Identifiers

• Canonical Smiles: C(CCN)CC(C(=O)O)N.Cl.Cl
• IUPAC Name: 2,6-diaminohexanoic acid;dihydrochloride
• InChIKey: JBBURJFZIMRPCZ-UHFFFAOYSA-N
• INCHI: 1S/C6H14N2O2.2ClH/c7-4-2-1-3-5(8)6(9)10;;/h5H,1-4,7-8H2,(H,9,10);2*1H
• Isomeric SMILES: C(CCN)CC(C(=O)O)N.Cl.Cl
• WGK Germany: 3
• PubChem CID: 517175
• Molecular Weight: 219.11

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: Medium-chain fatty acids Amino fatty acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Medium-chain fatty acid - Amino fatty acid - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary aliphatic amine - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Amine - 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

• Sensitivity: Moisture sensitive.
• Molecular Weight: 219.110 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 218.059 Da
• Monoisotopic Mass: 218.059 Da
• Topological Polar Surface Area: 89.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 106.000
• 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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