D-(+)-3-Phenyllactic acid - 10mM in DMSO , CAS No.7326-19-4

CAS: 7326-19-4 Cat. No.: D425723 分子式: C₉H₁₀O₃ 分子量: 166.17 Beilstein Registry Number: 2209793 EC番号: 230-803-3

グレード＆純度 10mM in DMSO

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

Store at -80°C

Shipped In

Dry ice packs + Cold packs

概要

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

仕様

同義語

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 もっと見る

仕様と純度

10mM in DMSO

保管条件

Store at -80°C

入荷

Dry ice packs + Cold packs

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

アクションタイプ

INHIBITOR

名前と識別子

パブケム・シド

528763978

カノニカル・スマイル

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

異性体SMILES

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

WGKドイツ

3

分子量

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
    • 分類 Phenylpropanoic acids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• 分類: 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
• 説明: 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

化学的性質と物理的性質

• 比旋光度［α］: 22° (C=2,H2O)
• 融点（°C）: 122-124°C
• 分子量: 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