D-Erythrulose - 1M in Water , CAS No.496-55-9

CAS: 496-55-9 Cat. No.: D347396 Formula: C₄H₈O₄ Peso molecolare: 120.1

GRADE & PURITY 1M in Water

Synonyms

(3R)-1,3,4-trihydroxybutan-2-one | CHEBI:16023 | Erythrulose, (-)- | 2-Butanone, 1,3,4-trihydroxy-, (3R)- | D-Erythrulose (1M in Water) | D-glycero-Tetrulose | D-Glycero-2-tetrulose | DTXSID80420085 | (R)-1,3,4-Trihydroxybutan-2-one | 09058VOU0Z | C02022

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

(3R)-1,3,4-trihydroxybutan-2-one | CHEBI:16023 | Erythrulose, (-)- | 2-Butanone, 1,3,4-trihydroxy-, (3R)- | D-Erythrulose (1M in Water) | D-glycero-Tetrulose | D-Glycero-2-tetrulose | DTXSID80420085 | (R)-1,3,4-Trihydroxybutan-2-one | 09058VOU0Z | C02022

Specifiche e purezza

1M in Water

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

• Sorrisi canonici: C(C(C(=O)CO)O)O
• IUPAC Name: (3R)-1,3,4-trihydroxybutan-2-one
• InChIKey: UQPHVQVXLPRNCX-GSVOUGTGSA-N
• INCHI: 1S/C4H8O4/c5-1-3(7)4(8)2-6/h3,5-7H,1-2H2/t3-/m1/s1
• Isomeri SMILES: C([C@H](C(=O)CO)O)O
• Peso molecolare: 120.1
• Reaxy-Rn: 1721315
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1721315&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Monosaccharides
• Alternative Parents: Beta-hydroxy ketones Acyloins Alpha-hydroxy ketones Secondary alcohols Polyols Primary alcohols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monosaccharide - Beta-hydroxy ketone - Acyloin - Alpha-hydroxy ketone - Secondary alcohol - Ketone - Polyol - Organic oxide - Hydrocarbon derivative - Primary alcohol - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as monosaccharides. These are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn.
• External Descriptors: erythrulose

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

Proprietà chimiche e fisiche

• Solubilità: Soluble in water, and methanol.
• Peso molecolare: 120.100 g/mol
• XLogP3: -2.000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 120.042 Da
• Monoisotopic Mass: 120.042 Da
• Topological Polar Surface Area: 77.800 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 80.100
• 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

Domande frequenti

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 496-55-9, the molecular formula is C4H8O4, and the molecular weight is 120.1 g/mol. InChIKey UQPHVQVXLPRNCX-GSVOUGTGSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.