4-Aminophenyl disulfide - ≥98% , CAS No.722-27-0

CAS: 722-27-0 Cat. No.: A101817 Summenformel: (H₂NC₆H₄S-)₂ Molekulargewicht: 248.37 Beilstein Registry Number: 13536 EG-Nummer: 211-961-2

GRADE & PURITY ≥98%

Synonyms

4,4'-Diaminodiphenyldisulfide | 4-Aminophenyl disulfide, 95% | p,p'-Dithiobisaniline | D0291 | Di(4-aminophenyl) Disulfide | EINECS 211-961-2 | NSC62984 | NSC-62984 | NSC 62984 | NSC 677451 | 4-Aminophenyl disulfide, 98% | 4-[(4-aminophenyl)disulfanyl]ani

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonyme

4,4'-Diaminodiphenyldisulfide | 4-Aminophenyl disulfide, 95% | p,p'-Dithiobisaniline | D0291 | Di(4-aminophenyl) Disulfide | EINECS 211-961-2 | NSC62984 | NSC-62984 | NSC 62984 | NSC 677451 | 4-Aminophenyl disulfide, 98% | 4-[(4-aminophenyl)disulfanyl]ani

Spezifikationen & Reinheit

≥98%

Storage

Room temperature,Argon charged

Verschickt in

FedEx DG Service

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 504752402
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752402
• Kanonisches Lächeln: C1=CC(=CC=C1N)SSC2=CC=C(C=C2)N
• IUPAC Name: 4-[(4-aminophenyl)disulfanyl]aniline
• InChIKey: MERLDGDYUMSLAY-UHFFFAOYSA-N
• INCHI: 1S/C12H12N2S2/c13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12/h1-8H,13-14H2
• Isomere SMILES: C1=CC(=CC=C1N)SSC2=CC=C(C=C2)N
• WGK Deutschland: 3
• RTECS: BX9580000
• Molekulargewicht: 248.37
• Beilstein: 13536
• Reaxy-Rn: 1247117
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1247117&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Organic disulfides Sulfenyl compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Organic disulfide - Sulfenyl compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Beschreibung: 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Solubility in Methanol almost transparency
• Empfindlichkeit: Air & Light Sensitive
• Schmelzpunkt (°C): 77-78°C
• Molekulargewicht: 248.400 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 248.044 Da
• Monoisotopic Mass: 248.044 Da
• Topological Polar Surface Area: 103.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 175.000
• 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