Ethylenediamine diacetate - ≥98% , CAS No.38734-69-9

CAS: 38734-69-9 Cat. No.: E473257 Formule: C₆H₁₆N₂O₄ Poids moléculaire: 180.2

GRADE & PURITY ≥98%

Synonyms

DTXSID10436235 | Ethylenediamine diacetate | 1,2-Ethanediamine, diacetate | Ethane-1,2-diaminediacetate | SCHEMBL26819 | Ethylenediamine diacetate, 98% | MFCD00192147 | 1,2-Ethanediamine, acetate (1:2) | AKOS025295272 | Ethylenediamine diacetate 420352_AL

Storage

Room temperature

Specifications

Synonymes

DTXSID10436235 | Ethylenediamine diacetate | 1,2-Ethanediamine, diacetate | Ethane-1,2-diaminediacetate | SCHEMBL26819 | Ethylenediamine diacetate, 98% | MFCD00192147 | 1,2-Ethanediamine, acetate (1:2) | AKOS025295272 | Ethylenediamine diacetate 420352_AL

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature

Pureté

≥98%

Noms et identifiants

Sourires canoniques

CC(=O)O.CC(=O)O.C(CN)N

IUPAC Name

acetic acid;ethane-1,2-diamine

InChIKey

SAXQBSJDTDGBHS-UHFFFAOYSA-N

INCHI

1S/C2H8N2.2C2H4O2/c3-1-2-4;2*1-2(3)4/h1-4H2;2*1H3,(H,3,4)

Isomères SMILES

CC(=O)O.CC(=O)O.C(CN)N

Poids moléculaire

180.2

Reaxy-Rn

5444394

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5444394&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
• 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

Propriétés chimiques et physiques

• Point de fusion (°C): 118-120 °C
• Poids moléculaire: 180.200 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 180.111 Da
• Monoisotopic Mass: 180.111 Da
• Topological Polar Surface Area: 127.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 37.000
• 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: 3

XLogP3

Foire aux questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 38734-69-9, the molecular formula is C6H16N2O4, and the molecular weight is 180.2 g/mol. InChIKey SAXQBSJDTDGBHS-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.