1-fluoro-2-hydroxybutane-1,2,4-tricarboxylic acid
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1-fluoro-2-hydroxybutane-1,2,4-tricarboxylic acid
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CAS No:
131736-83-9
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Formula:
C7H9FO7
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Chemical Name:
1-fluoro-2-hydroxybutane-1,2,4-tricarboxylic acid
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Synonyms:
1-fluorohomocitrate;1-fluorohomocitrate, (R-(R*,S*))-isomer;1-fluorohomocitrate, (S-(R*,S*))-isomer;131736-83-9;1-Fluorohomocitrate;1-fluoro-2-hydroxybutane-1,2,4-tricarboxylic acid;ACMC-20mu7p;1,2,4-Butanetricarboxylicacid, 1-fluoro-2-hydroxy-;DTXSID30927332;1,2,4-Butanetricarboxylic acid, 1-fluoro-2-hydroxy-
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CAS No:
Computed Properties
Molecular Weight:224.14
XLogP3:-1.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:224.03323078
Monoisotopic Mass:224.03323078
Topological Polar Surface Area:132
Heavy Atom Count:15
Complexity:289
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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