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2-[2-(acetyloxy)-3,5,6-trichlorobenzenesulfinyl]-3,4,6-trichlorophenyl acetate

2-[2-(acetyloxy)-3,5,6-trichlorobenzenesulfinyl]-3,4,6-trichlorophenyl acetate

Formula: C16H8Cl6O5S

SMILES: CC(=O)OC1=C(Cl)C=C(Cl)C(Cl)=C1S(=O)C1=C(Cl)C(Cl)=CC(Cl)=C1OC(C)=O

IUPAC: 2-[2-(acetyloxy)-3,5,6-trichlorobenzenesulfinyl]-3,4,6-trichlorophenyl acetate

InChI: InChI=1S/C16H8Cl6O5S/c1-5(23)26-13-9(19)3-7(17)11(21)15(13)28(25)16-12(22)8(18)4-10(20)14(16)27-6(2)24/h3-4H,1-2H3

Composition: C (36.61%), H (1.54%), Cl (40.51%), O (15.24%), S (6.11%)

Molar Mass: 525

Atom Count: 36

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 521.8223607
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey RIJWFCBNOVMYPL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 111.21
Topological Polar Surface Area 69.67
Polarizability 44.35
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H8Cl6O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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