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263339-82-8 | Benzene, 1,3,5-trimethyl-2-[[4-[(tribromomethyl)sulfonyl]phenyl]sulfonyl]-
CAS No: 263339-82-8 Catalog No: AG002SRN MDL No:
Product Description
Catalog Number:
AG002SRN
Chemical Name:
Benzene, 1,3,5-trimethyl-2-[[4-[(tribromomethyl)sulfonyl]phenyl]sulfonyl]-
CAS Number:
263339-82-8
Molecular Formula:
C16H15Br3O4S2
Molecular Weight:
575.1299
IUPAC Name:
1,3,5-trimethyl-2-[4-(tribromomethylsulfonyl)phenyl]sulfonylbenzene
InChI:
InChI=1S/C16H15Br3O4S2/c1-10-8-11(2)15(12(3)9-10)24(20,21)13-4-6-14(7-5-13)25(22,23)16(17,18)19/h4-9H,1-3H3
InChI Key:
OBZZHCJCCORRTQ-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)C(Br)(Br)Br
Properties
Complexity:
654
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
573.794g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
575.124g/mol
Monoisotopic Mass:
571.796g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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