L-Tyrosine disodium salt hydrate - ≥98% , CAS No.69847-45-6

CAS: 69847-45-6 Cat. No.: L194654 Molecular Weight: 225.15(as Anhydrous) EC Number: 274-152-3

GRADE & PURITY ≥98%

Synonyms

UNII-196LT62R6Z | DTXSID30890037 | L-Tyrosine, sodium salt (1:2) | disodium;(2S)-2-amino-3-(4-oxidophenyl)propanoate | AKOS025213218 | T1423 | Tyrosine disodium anhydrous | L-Tyrosine disodium salt hydrate | L-Tyrosine disodium salt | MFCD00037203 | s1167

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Tyrosine is a polar, non-essential amino acid with a phenolic functionality. L-tyrosine is a natural amino acid that is incorporated into proteins as directed by the genetic code. The phenolic function makes the tyrosine residue in proteins a principle recipient of reactions such as phosphorylation/dephosphorylation important for cell signalling. Tyrosine is also a precursor of various neurotransmitters and hormones.

Specifications

Synonyms

UNII-196LT62R6Z | DTXSID30890037 | L-Tyrosine, sodium salt (1:2) | disodium;(2S)-2-amino-3-(4-oxidophenyl)propanoate | AKOS025213218 | T1423 | Tyrosine disodium anhydrous | L-Tyrosine disodium salt hydrate | L-Tyrosine disodium salt | MFCD00037203 | s1167

Specifications & Purity

≥98%

Storage

Store at 2-8°C

Shipped In

Wet ice

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

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504770269
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504770269
• Canonical Smiles: C1=CC(=CC=C1CC(C(=O)[O-])N)[O-].[Na+].[Na+]
• IUPAC Name: disodium;(2S)-2-amino-3-(4-oxidophenyl)propanoate
• InChIKey: ASIYFCYUCMQNGK-JZGIKJSDSA-L
• INCHI: 1S/C9H11NO3.2Na/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;;/h1-4,8,11H,5,10H2,(H,12,13);;/q;2*+1/p-2/t8-;;/m0../s1
• Isomeric SMILES: C1=CC(=CC=C1C[C@@H](C(=O)[O-])N)[O-].[Na+].[Na+]
• Alternate CAS: 122666-87-9
• Molecular Weight: 225.15(as Anhydrous)
• Reaxy-Rn: 23373207
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23373207&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 Phenylalanine 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 - Alpha amino acids and derivatives
• Direct Parent: Phenylalanine and derivatives
• Alternative Parents: Phenylpropanoic acids Amphetamines and derivatives L-alpha-amino acids Phenoxides Aralkylamines Amino acids Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Monoalkylamines Organic oxides Carbonyl compounds Organic sodium salts Organic zwitterions Organopnictogen compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Phenoxide - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Carboxylic acid salt - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Organic alkali metal salt - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Primary aliphatic amine - Organic nitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organic zwitterion - Organic sodium salt - Organic salt - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: organic sodium salt

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: heat sensitive；Moisture sensitive.
• Molecular Weight: 225.150 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 225.038 Da
• Monoisotopic Mass: 225.038 Da
• Topological Polar Surface Area: 89.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 170.000
• 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: 3

XLogP3

References

1. Fu-Qiang An, Hu-Fei Li, Xu-Dong Guo, Xiao-Yan Xue, Yong Wang, Tuo-Ping Hu, Jian-Feng Gao.  (2019)  Efficiently removing phenols from aqueous solution using amino acid functionalized D301 resins.  SEPARATION SCIENCE AND TECHNOLOGY,      [PMID:] [10.1080/01496395.2018.1546738]