L-Glutamic Acid 1-Methyl Ester - ≥95% , CAS No.6384-08-3

CAS: 6384-08-3 Cat. No.: G116980 Molecular Weight: 161.16 Beilstein Registry Number: 4(4)3032 EC Number: 873-237-8

GRADE & PURITY ≥95%

Synonyms

AKOS016843010 | Q27103780 | 1-MethylL-Glutamate | Glu(alpha-OMe)-OH | GluOMe | 1-Methyl L-Glutamate | glutamic acid methyl ester | L-Glutamic Acid 1-Methyl Ester | NCGC00015682-03 | DTXSID50331497 | Glutamic acid,1-methyl ester | SCHEMBL338792 | (S)-4-ami

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

AKOS016843010 | Q27103780 | 1-MethylL-Glutamate | Glu(alpha-OMe)-OH | GluOMe | 1-Methyl L-Glutamate | glutamic acid methyl ester | L-Glutamic Acid 1-Methyl Ester | NCGC00015682-03 | DTXSID50331497 | Glutamic acid, 1-methyl ester | SCHEMBL338792 | (S)-4-ami

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

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

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488189764
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488189764
• Canonical Smiles: COC(=O)C(CCC(=O)O)N
• IUPAC Name: (4S)-4-amino-5-methoxy-5-oxopentanoic acid
• InChIKey: SEWIYICDCVPBEW-BYPYZUCNSA-N
• INCHI: 1S/C6H11NO4/c1-11-6(10)4(7)2-3-5(8)9/h4H,2-3,7H2,1H3,(H,8,9)/t4-/m0/s1
• Isomeric SMILES: COC(=O)[C@H](CCC(=O)O)N
• Molecular Weight: 161.16
• Beilstein: 4(4)3032
• Reaxy-Rn: 3937548
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3937548&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Glutamic acid and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Glutamic acid and derivatives
• Alternative Parents: Alpha amino acid esters Fatty acid esters Amino fatty acids Dicarboxylic acids and derivatives Methyl esters Amino acids Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Glutamic acid or derivatives - Alpha-amino acid ester - Amino fatty acid - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Methyl ester - Carboxylic acid ester - Amino acid - Carboxylic acid - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as glutamic acid and derivatives. These are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: dicarboxylic acid monoester - methyl ester - L-glutamyl ester

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: Soluble in water.
• Sensitivity: Moisture Sensitive;Heat Sensitive
• Specific Rotation[α]: +35°
• Melt Point(°C): 145°C
• Molecular Weight: 161.160 g/mol
• XLogP3: -3.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 161.069 Da
• Monoisotopic Mass: 161.069 Da
• Topological Polar Surface Area: 89.600 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 157.000
• 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