5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid
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5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid
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CAS No:
6918-01-0
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Formula:
C6H5ClO4
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Chemical Name:
5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid
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Synonyms:
6918-01-0;5-chloro-6-hydroxy-2-oxohexa-3,5-dienoic acid;5-Chloro-2-hydroxymuconic semialdehyde;DTXSID10988885;2-Hydroxy-5-chloro-6-oxo-2,4-hexadienoic acid
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CAS No:
Computed Properties
Molecular Weight:176.55
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:175.9876363
Monoisotopic Mass:175.9876363
Topological Polar Surface Area:74.6
Heavy Atom Count:11
Complexity:229
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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