DL-Asparagine monohydrate - ≥99%(T) , CAS No.3130-87-8

CAS: 3130-87-8 Cat. No.: A108224 Formula: C₄H₈N₂O₃·H₂O Peso molecolare: 150.13 Beilstein Registry Number: 1723525 Numero EC: 221-521-1

GRADE & PURITY ≥99%(T)

Synonyms

2,4-diamino-4-oxobutanoic acid;hydrate | A-9020 | RBMGJIZCEWRQES-UHFFFAOYSA-N | D,L-Asn.H2O | AC-24125 | SCHEMBL50254 | BCP26438 | L-asparagine hydrate pound>>L(+)-Asparagine monohydrate | L-Asparagine-amide-15n monohydrate | Dl-Asparagine Hydrate | SY035

Storage

Room temperature,Desiccated

Shipped In

Normal

Panoramica

DL-Asparagine is a racemic melange of the Aparagine L and D-enantiomers. DL-Asparagine has been used in growth-media for bacteria-growth.

Specifications

Sinonimi

2,4-diamino-4-oxobutanoic acid;hydrate | A-9020 | RBMGJIZCEWRQES-UHFFFAOYSA-N | D,L-Asn.H2O | AC-24125 | SCHEMBL50254 | BCP26438 | L-asparagine hydrate pound>>L(+)-Asparagine monohydrate | L-Asparagine-amide-15n monohydrate | Dl-Asparagine Hydrate | SY035

Specifiche e purezza

≥99%(T)

Condizioni di conservazione di stoccaggio

Room temperature,Desiccated

Spedito in

Normal

Purezza

≥99%(T)

Nomi e identificatori

Pubchem Sid

488190121

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190121

Sorrisi canonici

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

IUPAC Name

2,4-diamino-4-oxobutanoic acid;hydrate

InChIKey

RBMGJIZCEWRQES-UHFFFAOYSA-N

INCHI

1S/C4H8N2O3.H2O/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H2,6,7)(H,8,9);1H2

Isomeri SMILES

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

WGK Germania

1

Peso molecolare

150.13

Beilstein

1723525

Reaxy-Rn

6234992

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6234992&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Asparagine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Asparagine and derivatives
• Alternative Parents: Alpha amino acids Fatty amides Fatty acids and conjugates Primary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Asparagine or derivatives - Alpha-amino acid - Fatty amide - Fatty acid - Fatty acyl - Carboxamide group - Primary carboxylic acid amide - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: Not available

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

• Punto di fusione (°C): 182-183°C
• Peso molecolare: 150.130 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 150.064 Da
• Monoisotopic Mass: 150.064 Da
• Topological Polar Surface Area: 107.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 134.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Domande frequenti

How should this product be stored?

Store at room temperature, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

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 3130-87-8, the molecular formula is C4H10N2O4, and the molecular weight is 150.13 g/mol. InChIKey RBMGJIZCEWRQES-UHFFFAOYSA-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.