3-acetamido-2,4,6-triiodo-5-(octanoylamino)benzoic acid
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3-acetamido-2,4,6-triiodo-5-(octanoylamino)benzoic acid
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CAS No:
67011-43-2
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Formula:
C17H21I3N2O4
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Chemical Name:
3-acetamido-2,4,6-triiodo-5-(octanoylamino)benzoic acid
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Synonyms:
67011-43-2;BENZOIC ACID, 3-ACETAMIDO-5-OCTANAMIDO-2,4,6-TRIIODO-;BRN 3479433;3-Acetamido-5-octanamido-2,4,6-triiodobenzoic acid;DTXSID20217214;3-(Acetylamino)-5-(octanoylamino)-2,4,6-triiodobenzoic acid
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CAS No:
3-acetamido-2,4,6-triiodo-5-(octanoylamino)benzoic acid Basic Attributes
698.07 g/mol
697.8635 g/mol
DTXSID20217214
Computed Properties
Molecular Weight:698.07
XLogP3:4.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:697.8635
Monoisotopic Mass:697.8635
Topological Polar Surface Area:95.5
Heavy Atom Count:26
Complexity:506
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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