Aminomalonic acid - 10mM in Water , CAS No.1068-84-4

CAS: 1068-84-4 Cat. No.: A420510 Summenformel: C₃H₅NO₄ Molekulargewicht: 119.1

GRADE & PURITY 10mM in Water

Synonyms

HY-112052 | 2-Aminopropanedioic Acid | DTXSID50147777 | Propanedioic acid, amino- | Aminomalonate | CHEBI:17475 | NSC 352096 | NSC352096 | NSC-352096 | Nitrogenc70f6047-a0cb-4f70-aa3a-78acd681efc3 | 6CCD2D0C-0A7C-484C-9A32-536715A4C39B | aminopropanedioic

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonyme

HY-112052 | 2-Aminopropanedioic Acid | DTXSID50147777 | Propanedioic acid, amino- | Aminomalonate | CHEBI:17475 | NSC 352096 | NSC352096 | NSC-352096 | Nitrogenc70f6047-a0cb-4f70-aa3a-78acd681efc3 | 6CCD2D0C-0A7C-484C-9A32-536715A4C39B | aminopropanedioic

Spezifikationen & Reinheit

10mM in Water

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Namen und Kennungen

Pubchem Sid

528756707

Kanonisches Lächeln

C(C(=O)O)(C(=O)O)N

IUPAC Name

2-aminopropanedioic acid

InChIKey

JINBYESILADKFW-UHFFFAOYSA-N

INCHI

1S/C3H5NO4/c4-1(2(5)6)3(7)8/h1H,4H2,(H,5,6)(H,7,8)

Isomere SMILES

C(C(=O)O)(C(=O)O)N

Molekulargewicht

119.1

Reaxy-Rn

1704564

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1704564&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives
            • Ebene7 Alpha amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acids
• Alternative Parents: Dicarboxylic acids and derivatives 1,3-dicarbonyl compounds Amino acids Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Dicarboxylic acid or derivatives - 1,3-dicarbonyl compound - Amino acid - Carboxylic acid - Hydrocarbon derivative - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• External Descriptors: amino dicarboxylic 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 119.080 g/mol
• XLogP3: -3.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 119.022 Da
• Monoisotopic Mass: 119.022 Da
• Topological Polar Surface Area: 101.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 106.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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