2,4-Diaminophenol Sulfate - ≥98% , CAS No.74283-34-4

CAS: 74283-34-4 Cat. No.: D154509 Formule: C₆H₈N₂O·H₂SO₄ Poids moléculaire: 222.22 Numéro CE: 627-125-9

GRADE & PURITY ≥98%

Synonyms

SCHEMBL1876910 | 2,4-diaminophenol;sulfuric acid | 2,4-Diaminophenolsulfate(1:x) | AKOS016004398 | DS-16639 | ZCA28334 | Sulfuric acid--2,4-diaminophenol (1/1) | MFCD01321156 | D90071 | 2,4-Diaminophenol sulfate(1:x) | DTXSID50591610 | D2499 | C6H10N2O5S

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

SCHEMBL1876910 | 2,4-diaminophenol;sulfuric acid | 2,4-Diaminophenolsulfate(1:x) | AKOS016004398 | DS-16639 | ZCA28334 | Sulfuric acid--2,4-diaminophenol (1/1) | MFCD01321156 | D90071 | 2,4-Diaminophenol sulfate(1:x) | DTXSID50591610 | D2499 | C6H10N2O5S

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

488199567

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488199567

Sourires canoniques

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

IUPAC Name

2,4-diaminophenol;sulfuric acid

InChIKey

JKMWKYDJCPSJSI-UHFFFAOYSA-N

INCHI

1S/C6H8N2O.H2O4S/c7-4-1-2-6(9)5(8)3-4;1-5(2,3)4/h1-3,9H,7-8H2;(H2,1,2,3,4)

Isomères SMILES

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

Poids moléculaire

222.22

Reaxy-Rn

41219239

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=41219239&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: p-Aminophenols o-Aminophenols 1-hydroxy-2-unsubstituted benzenoids Organic sulfuric acids Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenol - P-aminophenol - O-aminophenol - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Sulfuric acid - Phenol - Organic sulfuric acid or derivatives - Amine - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

• Solubilité: Soluble in water
• Poids moléculaire: 222.220 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 0
• Exact Mass: 222.031 Da
• Monoisotopic Mass: 222.031 Da
• Topological Polar Surface Area: 155.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 178.000
• 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: 2

XLogP3