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

CAS: 17392-83-5 Cat. No.: M132799 Molecular Weight: 104.11 Beilstein Registry Number: 3(4)449 EC Number: 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

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

Specifications & Purity

≥98%(GC)

Storage

Room temperature, Argon charged

Shipped In

FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%(GC)

Names and Identifiers

• Canonical Smiles: 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
• Isomeric SMILES: C[C@H](C(=O)OC)O
• WGK Germany: 1
• UN Number: 3272
• Packing Group: III
• Molecular Weight: 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
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid esters
          • Level6 Methyl esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: 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
• Description: 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

Chemical and Physical Properties

• Solubility: Completely miscible with water and decomposed by contact with water; Miscible with alcohol
• Sensitivity: Moisture sensitive
• Refractive Index: 1.41
• Specific Rotation[α]: [α]D：8°
• Flash Point(°F): 120.2 °F
• Flash Point(°C): 56°C(lit.)
• Boil Point(°C): 144-145 °C (lit.)
• Molecular Weight: 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