1-((4-(1,1-Dimethylethyl)phenyl)thio)-4,5,8-tris(phenylthio)anthraquinone

Base Information

• Chemical Name: 1-((4-(1,1-Dimethylethyl)phenyl)thio)-4,5,8-tris(phenylthio)anthraquinone
• CAS No.: 83929-63-9
• Molecular Formula: C42H32O2S4
• Molecular Weight: 696.9623
• European Community (EC) Number: 281-356-6
• DSSTox Substance ID: DTXSID401004106
• Nikkaji Number: J332.918F
• Wikidata: Q82998935
• Mol file: 83929-63-9.mol

Synonyms:83929-63-9;EINECS 281-356-6;1-((4-(1,1-Dimethylethyl)phenyl)thio)-4,5,8-tris(phenylthio)anthraquinone;ABHXLCBSTASDKL-UHFFFAOYSA-N;DTXSID401004106;NS00061068;1-[(4-tert-Butylphenyl)sulfanyl]-4,5,8-tris(phenylsulfanyl)anthracene-9,10-dione

Chemical Property of 1-((4-(1,1-Dimethylethyl)phenyl)thio)-4,5,8-tris(phenylthio)anthraquinone

Chemical Property:

• Vapor Pressure: 6.43E-29mmHg at 25°C
• Boiling Point: 846.5°Cat760mmHg
• Flash Point: 329.8°C
• PSA: 135.34000
• Density: 1.36g/cm³
• LogP: 12.36430
• XLogP3: 12.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 696.12851495
• Heavy Atom Count: 48
• Complexity: 1060

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)SC2=C3C(=C(C=C2)SC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)SC6=CC=CC=C6)SC7=CC=CC=C7

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