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1774-27-2 | Benzene, 1-[(4-methylphenyl)sulfonyl]-4-(phenylsulfonyl)-
CAS No: 1774-27-2 Catalog No: AG0025AW MDL No:
Product Description
Catalog Number:
AG0025AW
Chemical Name:
Benzene, 1-[(4-methylphenyl)sulfonyl]-4-(phenylsulfonyl)-
CAS Number:
1774-27-2
Molecular Formula:
C19H16O4S2
Molecular Weight:
372.4579
IUPAC Name:
1-[4-(benzenesulfonyl)phenyl]sulfonyl-4-methylbenzene
InChI:
InChI=1S/C19H16O4S2/c1-15-7-9-17(10-8-15)25(22,23)19-13-11-18(12-14-19)24(20,21)16-5-3-2-4-6-16/h2-14H,1H3
InChI Key:
HRIQSMFQLWETLY-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)c1ccccc1
NSC Number:
140328
Properties
Complexity:
620
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.049g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
372.453g/mol
Monoisotopic Mass:
372.049g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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