3-Amino-2,4,6-triiodo-α-methylbenzeneacetic acid
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3-Amino-2,4,6-triiodo-α-methylbenzeneacetic acid
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CAS No:
21762-12-9
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Formula:
C9H8I3NO2
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Chemical Name:
3-Amino-2,4,6-triiodo-α-methylbenzeneacetic acid
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Synonyms:
Benzeneacetic acid,3-amino-2,4,6-triiodo-α-methyl-;Hydratropic acid,3-amino-2,4,6-triiodo-;3-Amino-2,4,6-triiodo-α-methylbenzeneacetic acid;2-(3-Amino-2,4,6-triiodophenyl)propanoic acid
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CAS No:
Computed Properties
Molecular Weight:542.88
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:542.7689
Monoisotopic Mass:542.7689
Topological Polar Surface Area:63.3
Heavy Atom Count:15
Complexity:252
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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