Bis(4-hydroxyphenyl) Disulfide - ≥98% , CAS No.15015-57-3

CAS: 15015-57-3 Cat. No.: B152486 Peso molecular: 250.33 Número EC: 805-758-3

GRADE & PURITY ≥98%

Synonyms

A809013 | D81808 | di(4-hydroxyphenyl)-disulfide | L-Glutamic acid, N-(N-acetyl-L-beta-aspartyl)- | EN300-352281 | NSC132570 | NSC-132570 | AKOS022140244 | A25032 | 4,4'-Dithiodiphenol | 4-hydroxyphenyldisulfide | Bis(4-hydroxyphenyl)disulfide | STL323480

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

A809013 | D81808 | di(4-hydroxyphenyl)-disulfide | L-Glutamic acid, N-(N-acetyl-L-beta-aspartyl)- | EN300-352281 | NSC132570 | NSC-132570 | AKOS022140244 | A25032 | 4, 4'-Dithiodiphenol | 4-hydroxyphenyldisulfide | Bis(4-hydroxyphenyl)disulfide | STL323480

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Tipo de acción

INHIBITOR

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504758286
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758286
• Sonrisas canónicas: C1=CC(=CC=C1O)SSC2=CC=C(C=C2)O
• IUPAC Name: 4-[(4-hydroxyphenyl)disulfanyl]phenol
• InChIKey: XGKGITBBMXTKTE-UHFFFAOYSA-N
• INCHI: 1S/C12H10O2S2/c13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12/h1-8,13-14H
• Isómeros SMILES: C1=CC(=CC=C1O)SSC2=CC=C(C=C2)O
• Peso molecular: 250.33
• Reaxy-Rn: 1973875
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1973875&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenols
      • Subclass 1-hydroxy-2-unsubstituted benzenoids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenols
• Subclass: 1-hydroxy-2-unsubstituted benzenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-hydroxy-2-unsubstituted benzenoids
• Alternative Parents: Benzene and substituted derivatives Organic disulfides Sulfenyl compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic disulfide - Sulfenyl compound - Organic oxygen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 1-hydroxy-2-unsubstituted benzenoids. These are phenols that a unsubstituted at the 2-position.
• 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

Objetivos asociados (humanos)

TYR Tclin Tyrosinase (717 Activities)

Discover Target: TYR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in methanol
• Punto de fusión (°C): 150 - 154°C
• Peso molecular: 250.300 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 250.012 Da
• Monoisotopic Mass: 250.012 Da
• Topological Polar Surface Area: 91.100 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

Referencias

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