Diglycine Hydrochloride Monohydrate - ≥98%(N) , CAS No.13059-60-4

CAS: 13059-60-4 Cat. No.: D302344 Formula: C₄H₈N₂O₃·HCl·H₂O Peso molecolare: 186.6

GRADE & PURITY ≥98%(N)

Synonyms

Glycine, glycyl-, hydrochloride | Diglycine Hydrochloride | AKOS008029209 | H-Gly-Gly-OH.HCl | N-Glycylglycine HCl | FT-0636786 | N-Glycylglycine monohydrochloride | EINECS 235-951-2 | SCHEMBL2452130 | 2-[(2-aminoacetyl)amino]acetic acid;hydrochloride | D

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinonimi

Glycine, glycyl-, hydrochloride | Diglycine Hydrochloride | AKOS008029209 | H-Gly-Gly-OH.HCl | N-Glycylglycine HCl | FT-0636786 | N-Glycylglycine monohydrochloride | EINECS 235-951-2 | SCHEMBL2452130 | 2-[(2-aminoacetyl)amino]acetic acid;hydrochloride | D

Specifiche e purezza

≥98%(N)

Condizioni di conservazione di stoccaggio

Room temperature,Desiccated

Spedito in

Normal

Purezza

≥98%(N)

Nomi e identificatori

Pubchem Sid

488186147

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186147

Sorrisi canonici

C(C(=O)NCC(=O)O)N.Cl

IUPAC Name

2-[(2-aminoacetyl)amino]acetic acid;hydrochloride

InChIKey

YHBAZQDEMYQPJL-UHFFFAOYSA-N

INCHI

1S/C4H8N2O3.ClH/c5-1-3(7)6-2-4(8)9;/h1-2,5H2,(H,6,7)(H,8,9);1H

Isomeri SMILES

C(C(=O)NCC(=O)O)N.Cl

CAS alternativo

23273-91-8

Peso molecolare

186.6

Reaxy-Rn

4154557

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4154557&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: N-acyl-alpha amino acids Alpha amino acid amides Secondary carboxylic acid amides 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-dipeptide - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Amino acid - Monocarboxylic acid or derivatives - Carboxylic acid - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Primary aliphatic amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrochloride - Hydrocarbon derivative - Amine - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• 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

Proprietà chimiche e fisiche

• Peso molecolare: 168.580 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 168.03 Da
• Monoisotopic Mass: 168.03 Da
• Topological Polar Surface Area: 92.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 123.000
• 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