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2,2,2-trifluoro-N-{2-[2-(2,2,2-trifluoroacetamido)ethanesulfinyl]ethyl}acetamide

2,2,2-trifluoro-N-{2-[2-(2,2,2-trifluoroacetamido)ethanesulfinyl]ethyl}acetamide

Formula: C8H10F6N2O3S

SMILES: FC(F)(F)C(=O)NCCS(=O)CCNC(=O)C(F)(F)F

IUPAC: 2,2,2-trifluoro-N-{2-[2-(2,2,2-trifluoroacetamido)ethanesulfinyl]ethyl}acetamide

InChI: InChI=1S/C8H10F6N2O3S/c9-7(10,11)5(17)15-1-3-20(19)4-2-16-6(18)8(12,13)14/h1-4H2,(H,15,17)(H,16,18)

Composition: C (29.27%), H (3.07%), F (34.73%), N (8.53%), O (14.62%), S (9.77%)

Molar Mass: 328.23

Atom Count: 30

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 328.031632342
Formal Charge 0
FSP3 0.75
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey XNVNKCODWHWCFR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.7
Topological Polar Surface Area 75.27
Polarizability 21.19
Ring Count 0
Rotatable Bond Count 8

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C8H10F6N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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