D-(+)-3-Phenyllactic acid - Moligand™, ≥98% , CAS No.7326-19-4

CAS: 7326-19-4 Cat. No.: P102443 Summenformel: C₉H₁₀O₃ Molekulargewicht: 166.17 Beilstein Registry Number: 2209793 EG-Nummer: 230-803-3

QUALITÄT & REINHEIT Moligand™, ≥98%

Synonyms

l-2-hydroxy-3-phenyl-propionic acid|(s)-a-hydroxy-benzenepropanoate|(R)-(+)-2-Hydroxy-3-phenylpropionic Acid|D/L-3-phenyllactic acid|(rac)-2-hydroxy-3-phenylpropionic acid|3-Phenyllactic acid, (R)-|(s)-b-phenyllactic|(R)-(+)-3-Phenyllactic Acid|(-)-2-Hydroxy-3-phenylpropionate|(s)-a-hydroxy-benzenepropanoic acid|3-Phenyl-D-lactic acid|(R)-2-hydroxy-3-phenylpropanoicacid|(s)-beta-phenyllactic|L-3-Phenyllactate|(+)-2-Hydroxy-3-phenylpropionic acid|(s)-alpha-hydroxy-benzenepropanoate|(R)-2-Hydroxy-3-phenylpropionic acid|(-)-2-Hydroxy-3-phenylpropionic acid|(-)-2-Hydroxy-3-phenylpropanoate|L-Phenyl Lactate|(-)-b-phenyllactic acid|(2R)-2-hydroxy-3-phenylpropanoic acid|(2R)-2-Hydroxy-3-phenyl-propanoic acid|(S)-3-phenyl-Lactate|(R)-3-Phenyllactic acid|D-(+)-3-Phenyllactic acid|(2R)-hydroxy-3-phenylpropanoic acid|D-(+)-Phenyllactic acid|(R)-2-hydroxy-3-phenylpropanoic acid|A-Hydroxy-3-phenylpropionic acid|(-)-3-Phenyllactate|(-)-beta-phenyllactate|D-3-phenyllactic acid|(-)-beta-phenyllactic acid|(R)-3-(phenyl)lactate|(S)-3-phenyl-Lactic acid|(2S)-2-Hydroxy-3-phenylpropionate|(2S)-2-Hydroxy-3-phenylpropionic acid|(s)-alpha-hydroxy-benzenepropanoic acid|(-)-b-phenyllactate

Storage

Room temperature

Shipped In

Normal

Übersicht

Chiral building block employed in the preparation of statine. Starting material in the preparation of the hypoglycemic agent enlitazone and of 15N-labeled phenylalanine.

Spezifikationen

Synonyme

l-2-hydroxy-3-phenyl-propionic acid | (s)-a-hydroxy-benzenepropanoate | (R)-(+)-2-Hydroxy-3-phenylpropionic Acid | D/L-3-phenyllactic acid | (rac)-2-hydroxy-3-phenylpropionic acid | 3-Phenyllactic acid, (R)- | (s)-b-phenyllactic | (R)-(+)-3-Phenyllactic Acid | (-)-2-Hydroxy-3-phenylpropionate | (s)-a-hydroxy-benzenepropanoic acid | 3-Phen Show more

Spezifikationen & Reinheit

Moligand™, ≥98%

Storage

Room temperature

Verschickt in

Normal

Note

Moligand™

Aktionsart

INHIBITOR

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488190957

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190957

Kanonisches Lächeln

C1=CC=C(C=C1)CC(C(=O)O)O

IUPAC Name

(2R)-2-hydroxy-3-phenylpropanoic acid

InChIKey

VOXXWSYKYCBWHO-MRVPVSSYSA-N

INCHI

1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m1/s1

Isomere SMILES

C1=CC=C(C=C1)C[C@H](C(=O)O)O

WGK Deutschland

3

Molekulargewicht

166.17

Beilstein

2209793

Reaxy-Rn

2209791

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2209791&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Klasse Phenylpropanoic acids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Klasse: Phenylpropanoic acids
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpropanoic acids
• Alternative Parents: Benzene and substituted derivatives Alpha hydroxy acids and derivatives Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 3-phenylpropanoic-acid - Alpha-hydroxy acid - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Alcohol - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
• External Descriptors: (2R)-2-hydroxy monocarboxylic acid - 3-phenyllactic 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water
• Spezifische Drehung [α]: 22° (C=2,H2O)
• Schmelzpunkt (°C): 122-124°C
• Molekulargewicht: 166.170 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 166.063 Da
• Monoisotopic Mass: 166.063 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 150.000
• 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: 1