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3421-08-7

3421-08-7 Structure

3421-08-7 Structure
IdentificationBack Directory
[Name]

2,5-Bis(phenylamino)-1,4-benzoquinone
[CAS]

3421-08-7
[Synonyms]

C.I.56000
Helindon Yellow CA
Helindon Yellow CAK
2,5-Bis(phenylamino)-p-benzoquinone
2,5-Bis(phenylamino)-1,4-benzoquinone
2,5-Bis(phenylamino)-2,5-cyclohexadiene-1,4-dione
2,5-Cyclohexadiene-1,4-dione, 2,5-bis(phenylamino)-
[Molecular Formula]

C18H14N2O2
[MOL File]

3421-08-7.mol
[Molecular Weight]

290.32
Chemical PropertiesBack Directory
[Melting point ]

300 °C (decomp)
[Boiling point ]

471.9±45.0 °C(Predicted)
[density ]

1.370±0.06 g/cm3(Predicted)
[solubility ]

Trifluoroacetic acid: Soluble
[form ]

Solid
[pka]

-1.60±0.20(Predicted)
[InChI]

InChI=1S/C18H14N2O2/c21-17-12-16(20-14-9-5-2-6-10-14)18(22)11-15(17)19-13-7-3-1-4-8-13/h1-12,19-20H
[InChIKey]

GETDOINCEIMJDH-UHFFFAOYSA-N
[SMILES]

C1(=O)C=C(NC2=CC=CC=C2)C(=O)C=C1NC1=CC=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319
[Precautionary statements ]

P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330
Hazard InformationBack Directory
[Uses]

2,5-Bis((phenyl-d5)amino)cyclohexa-2,5-diene-1,4-dione is an isotopic labelled compound of 2,5-Bis(phenylamino)-2,5-cyclohexadiene-1,4-dione (B674595), a dynamin GTPase inhibitor. An antiureolytic.
[References]

[1] HAOQI NINA ZHAO, EDWARD P. KOLODZIEJ*   Screening p-Phenylenediamine Antioxidants, Their Transformation Products, and Industrial Chemical Additives in Crumb Rubber and Elastomeric Consumer Products[J]. 环境科学与技术, 2023, 57 7: 2779-2791. DOI: 10.1021/acs.est.2c07014
[2] WEI WANG, ZONGWEI CAI*   Beyond Substituted p-Phenylenediamine Antioxidants: Prevalence of Their Quinone Derivatives in PM2.5[J]. 环境科学与技术, 2022, 56 15: 10629-10637. DOI: 10.1021/acs.est.2c02463
[3] GUODONG CAO, ZONGWEI CAI*   Occurrence and Fate of Substituted p-Phenylenediamine-Derived Quinones in Hong Kong Wastewater Treatment Plants[J]. 环境科学与技术, 2023, 57 41: 15635-15643. DOI: 10.1021/acs.est.3c03758
[4] AMALYN NAIN-PEREZ. Antiureolytic Activity of Substituted 2,5-Diaminobenzoquinones[J]. Chemistry & Biodiversity, 2019, 16 12. DOI: 10.1002/cbdv.201900503
[5] WEI WANG . Toxicity of substituted p-phenylenediamine antioxidants and their derived novel quinones on aquatic bacterium: Acute effects and mechanistic insights[J]. Journal of Hazardous Materials, 2024, 469: Article 133900. DOI: 10.1016/j.jhazmat.2024.133900
Spectrum DetailBack Directory
[Spectrum Detail]

2,5-Bis(phenylamino)-1,4-benzoquinone(3421-08-7)IR1
2,5-Bis(phenylamino)-1,4-benzoquinone(3421-08-7)IR2
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