2,4-Diaminobenzaldehyde - ≥98% , CAS No.98276-57-4

CAS: 98276-57-4 Cat. No.: D196142 Formule: C₇H₈N₂O Poids moléculaire: 136.15 Numéro CE: 110-863-6

GRADE & PURITY ≥98%

Synonyms

MFCD02094162 | 2,4-diaminobenzaldehyde | 2,4-diamino-benzaldehyde | Benzaldehyde, 2,4-diamino- | DS-5534 | SCHEMBL2334691 | DTXSID20456828 | AKOS006230138 | VMFJRVFZHAPENO-UHFFFAOYSA-N | 2,4-Diaminobenzaldehyde, AldrichCPR | A858563

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonymes

MFCD02094162 | 2,4-diaminobenzaldehyde | 2,4-diamino-benzaldehyde | Benzaldehyde, 2,4-diamino- | DS-5534 | SCHEMBL2334691 | DTXSID20456828 | AKOS006230138 | VMFJRVFZHAPENO-UHFFFAOYSA-N | 2,4-Diaminobenzaldehyde, AldrichCPR | A858563

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at 2-8°C,Protected from light,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Sourires canoniques

C1=CC(=C(C=C1N)N)C=O

IUPAC Name

2,4-diaminobenzaldehyde

InChIKey

VMFJRVFZHAPENO-UHFFFAOYSA-N

INCHI

1S/C7H8N2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4H,8-9H2

Isomères SMILES

C1=CC(=C(C=C1N)N)C=O

Poids moléculaire

136.15

Reaxy-Rn

3235332

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3235332&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Benzaldehydes Aniline and substituted anilines Vinylogous amides Primary amines Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Benzoyl - Benzaldehyde - Aryl-aldehyde - Vinylogous amide - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aldehyde - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• 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

• Sensibilité: air sensitive
• Poids moléculaire: 136.150 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 136.064 Da
• Monoisotopic Mass: 136.064 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 127.000
• 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

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 2–8 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 98276-57-4, the molecular formula is C7H8N2O, and the molecular weight is 136.15 g/mol. InChIKey VMFJRVFZHAPENO-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.