DL-α-Phenylglycine - ≥98% , CAS No.2835-06-5

CAS: 2835-06-5 Cat. No.: P101745 Molecular Weight: 151.16 Beilstein Registry Number: 3197862 EC Number: 220-608-1

GRADE & PURITY ≥98%

Synonyms

A22760 | AKOS000121220 | Amino(phenyl)acetic acid-, (S)- | A-Phenylglycine | DL-alpha-aminophenylacetate | amino(phenyl)acetate | DL-alpha-phenylaminoacetate | MFCD00064402 | Phenylglycine dl | alpha-Aminophenylacetic acid | Benzeneacetic acid, .alpha.-am

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

DL-α-Phenylglycine is used as a reagent in the synthesis of benzoquinone-amino acid conjugates which have antibacterial activity.

Specifications

Synonyms

A22760 | AKOS000121220 | Amino(phenyl)acetic acid-, (S)- | A-Phenylglycine | DL-alpha-aminophenylacetate | amino(phenyl)acetate | DL-alpha-phenylaminoacetate | MFCD00064402 | Phenylglycine dl | alpha-Aminophenylacetic acid | Benzeneacetic acid, .alpha.-am

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: 488179804
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488179804
• Canonical Smiles: C1=CC=C(C=C1)C(C(=O)O)N
• IUPAC Name: 2-amino-2-phenylacetic acid
• InChIKey: ZGUNAGUHMKGQNY-UHFFFAOYSA-N
• INCHI: 1S/C8H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H,10,11)
• Isomeric SMILES: C1=CC=C(C=C1)C(C(=O)O)N
• WGK Germany: 3
• Molecular Weight: 151.16
• Beilstein: 3197862
• Reaxy-Rn: 608018
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=608018&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 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: Aralkylamines Benzene and substituted derivatives Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alpha-amino acid - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Primary aliphatic amine - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Amine - Aromatic homomonocyclic 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: non-proteinogenic alpha-amino acid

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

Associated Targets(non-human)

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Solubility in Sodium hydroxide solution almost transparency
• Melt Point(°C): 290°C
• Molecular Weight: 151.160 g/mol
• XLogP3: -1.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 151.063 Da
• Monoisotopic Mass: 151.063 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 141.000
• 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: 1