Isopropylidenedi-p-phenylene bis(2-nitrobenzenesulphonate)

Base Information

• Chemical Name: Isopropylidenedi-p-phenylene bis(2-nitrobenzenesulphonate)
• CAS No.: 84963-06-4
• Molecular Formula: C27H22 N2 O10 S2
• Molecular Weight: 598.60098
• European Community (EC) Number: 284-808-0
• DSSTox Substance ID: DTXSID90234019
• Nikkaji Number: J23.059F
• Wikidata: Q83115729
• Mol file: 84963-06-4.mol

Synonyms:84963-06-4;Isopropylidenedi-p-phenylene bis(2-nitrobenzenesulphonate);EINECS 284-808-0;SCHEMBL9720821;DTXSID90234019;DZANUCWHWPTNPR-UHFFFAOYSA-N;ISOPROPYLIDENEDI-P-PHENYLENE BIS(2-NITROBENZENESULFONATE);NS00038721;W-111627

Chemical Property of Isopropylidenedi-p-phenylene bis(2-nitrobenzenesulphonate)

Chemical Property:

• PSA: 195.14000
• LogP: 8.57230
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 8
• Exact Mass: 598.07158725
• Heavy Atom Count: 41
• Complexity: 1030

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

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