Methyl D-(+)-Lactate - ≥98%(GC) , CAS No.17392-83-5

CAS: 17392-83-5 Cat. No.: M132799 分子式: C₄H₈O₃ 分子量: 104.11 Beilstein Registry Number: 3(4)449 EC番号: 241-420-6

GRADE & PURITY ≥98%(GC)

Synonyms

(R)-lactic acid, methyl ester | (R)-Methyl2-hydroxypropanoate | DTXSID201045071 | (R)-(+)-methyl lactate | (R)-methyl lactate | D-methyl lactate | methyl (2R)-2-oxidanylpropanoate | methyl (R)-2-hydroxypropanoate | methyl(R)-(+)-lactate | (+)-Methyl D-lac

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

同義語

(R)-lactic acid, methyl ester | (R)-Methyl2-hydroxypropanoate | DTXSID201045071 | (R)-(+)-methyl lactate | (R)-methyl lactate | D-methyl lactate | methyl (2R)-2-oxidanylpropanoate | methyl (R)-2-hydroxypropanoate | methyl(R)-(+)-lactate | (+)-Methyl D-lac

仕様と純度

≥98%(GC)

保管条件

Room temperature,Argon charged

入荷

FedEx DG Service

純度

≥98%(GC)

名前と識別子

パブケム・シド

508810403

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/508810403

カノニカル・スマイル

CC(C(=O)OC)O

IUPAC Name

methyl (2R)-2-hydroxypropanoate

InChIKey

LPEKGGXMPWTOCB-GSVOUGTGSA-N

INCHI

1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3/t3-/m1/s1

異性体SMILES

C[C@H](C(=O)OC)O

WGKドイツ

1

UN番号

3272

包装グループ

III

分子量

104.11

Beilstein

3(4)449

Reaxy-Rn

1720586

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1720586&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid esters
          • Level6 Methyl esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters
• Direct Parent: Methyl esters
• Alternative Parents: Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Methyl ester - Secondary alcohol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl group.
• External Descriptors: methyl 2-hydroxypropionate

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: Completely miscible with water and decomposed by contact with water; Miscible with alcohol
• 感度: Moisture sensitive
• 屈折率: 1.41
• 比旋光度［α］: [α]D：8°
• 引火点（°F）: 120.2 °F
• 引火点（°C）: 56°C(lit.)
• 沸点（°C）: 144-145 °C (lit.)
• 分子量: 104.100 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 104.047 Da
• Monoisotopic Mass: 104.047 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 69.300
• 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