1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1)
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1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1)
structure -
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CAS No:
94159-77-0
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Formula:
C19H19F23NO3.I
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Chemical Name:
1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1)
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Synonyms:
1-Tridecanaminium,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-,iodide (1:1);1-Tridecanaminium,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-,iodide
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CAS No:
1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1) Basic Attributes
873.2268036
873.004
303-258-5
1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1) Use and Manufacturing
PFAS (per- and polyfluoroalkyl substances) -> OECD Category
Computed Properties
Molecular Weight:873.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:27
Rotatable Bond Count:16
Exact Mass:873.00424
Monoisotopic Mass:873.00424
Topological Polar Surface Area:60.7
Heavy Atom Count:47
Complexity:1020
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
1-Tridecanaminium, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,13,13,13-eicosafluoro-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-12-(trifluoromethyl)-, iodide (1:1)
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