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124737-97-9 | Disulfone, 4-(1-methylethyl)phenyl phenyl
CAS No: 124737-97-9 Catalog No: AG000MP4 MDL No:
Product Description
Catalog Number:
AG000MP4
Chemical Name:
Disulfone, 4-(1-methylethyl)phenyl phenyl
CAS Number:
124737-97-9
Molecular Formula:
C15H16O4S2
Molecular Weight:
324.4151
IUPAC Name:
1-(benzenesulfonylsulfonyl)-4-propan-2-ylbenzene
InChI:
InChI=1S/C15H16O4S2/c1-12(2)13-8-10-15(11-9-13)21(18,19)20(16,17)14-6-4-3-5-7-14/h3-12H,1-2H3
InChI Key:
SBLBXZBAXCXCEH-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)S(=O)(=O)S(=O)(=O)c1ccccc1)C
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.409g/mol
Monoisotopic Mass:
324.049g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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