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[3-(benzenesulfonyl)propanesulfonyl]benzene

[3-(benzenesulfonyl)propanesulfonyl]benzene

CAS: 53893-41-7

Formula: C15H16O4S2

SMILES: O=S(=O)(CCCS(=O)(=O)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: [3-(benzenesulfonyl)propanesulfonyl]benzene

InChI: InChI=1S/C15H16O4S2/c16-20(17,14-8-3-1-4-9-14)12-7-13-21(18,19)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2

Composition: C (55.54%), H (4.97%), O (19.73%), S (19.77%)

Molar Mass: 324.41

Atom Count: 37

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 324.049001343
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey QURGPHCWOBAAOD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 82.85
Topological Polar Surface Area 68.28
Polarizability 33.73
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 53893-41-7 $51.35-$86.31$51.35$63.37$86.31
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