D-(+)-3-フェニル乳酸 - Moligand™, ≥98% , CAS No.7326-19-4

CAS: 7326-19-4 Cat. No.: P102443 分子式: C₉H₁₀O₃ 分子量: 166.17 Beilstein Registry Number: 2209793 EC番号: 230-803-3

GRADE & PURITY Moligand™, ≥98%

Synonyms

D-?(+)?-?Phenyllactic acid | l-2-hydroxy-3-phenyl-propionic acid | SCHEMBL180366 | (s)-a-hydroxy-benzenepropanoate | (R)-(+)-2-Hydroxy-3-phenylpropionic Acid | HY-30219 | AKOS005146076 | D/L-3-phenyllactic acid | (rac)-2-hydroxy-3-phenylpropionic acid | 3

Storage

Room temperature

Shipped In

ノーマル

概要

スタチンの調製に使用されるキラルなビルディングブロック。血糖降下剤エンリタゾンおよび15N標識フェニルアラニンの調製における出発物質。

Specifications

同義語

D-?(+)?-?Phenyllactic acid | l-2-hydroxy-3-phenyl-propionic acid | SCHEMBL180366 | (s)-a-hydroxy-benzenepropanoate | (R)-(+)-2-Hydroxy-3-phenylpropionic Acid | HY-30219 | AKOS005146076 | D/L-3-phenyllactic acid | (rac)-2-hydroxy-3-phenylpropionic acid | 3

仕様と純度

Moligand™, ≥98%

保管条件

Room temperature

入荷

ノーマル

等級

Moligand™

アクションタイプ

INHIBITOR

純度

≥98%

名前と識別子

• パブケム・シド: 488190957
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/488190957
• 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

• 溶解度: Soluble in water
• 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

参考文献

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5. Mingyang Hu, Ying He, Yunying Wang, Hongzhi Du, Liang Wang, Jie Yang, Yun Liu.  (2026)  Dual Active Sites of Metal-Free N,S-Doped Lignin-Derived Carbon Catalysts for Oxidative Esterification Depolymerization of Polyethylene Terephthalate.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.5c12502]

6. Jingfei Wang, Shuting Li, Liwu Liu, Fukai Liu, Cheng Lin, Yanju Liu, Jinsong Leng.  (2026)  4D-Printed Intelligent Reconfigurable Occluder With Anti-Thrombotic and Rapid-Repairing Capabilities for Patent Foramen Ovale.  Advanced Healthcare Materials,      [PMID:41645865] [10.1002/adhm.202505214]

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