5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1H-pyrimidine-2,4-dione
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5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1H-pyrimidine-2,4-dione
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CAS No:
80384-59-4
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Formula:
C7H3F7N2O2
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Chemical Name:
5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1H-pyrimidine-2,4-dione
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Synonyms:
NSC649070;5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)pyrimidine-2,4(1h,3h)-dione;CHEMBL1979180;DTXSID20896381;ZINC1631667;5-(1,2,2,2-Tetrafluoro-1-trifluoromethylethyl)-1H-pyrimidine--dione;AKOS000588693;NSC-649070;80384-59-4;NCI60_017088;5-[1,2,2,2-Tetrafluoro-1-(trifluoromethyl)ethyl]-2,4(1H,3H)-pyrimidinedione #
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CAS No:
5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1H-pyrimidine-2,4-dione Basic Attributes
280.10 g/mol
280.00827448 g/mol
649070
5-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1H-pyrimidine-2,4-dione Use and Manufacturing
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
Computed Properties
Molecular Weight:280.10
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:1
Exact Mass:280.00827448
Monoisotopic Mass:280.00827448
Topological Polar Surface Area:58.2
Heavy Atom Count:18
Complexity:409
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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