3-(4-chlorophenyl)-3-oxopropanoic acid
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3-(4-chlorophenyl)-3-oxopropanoic acid
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CAS No:
17589-68-3
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Formula:
C9H7ClO3
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Chemical Name:
3-(4-chlorophenyl)-3-oxopropanoic acid
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Synonyms:
3-(4-chlorophenyl)-3-oxopropanoic acid;17589-68-3;NSC126610;[Chlor-2-benzoyl]-essigsaure;SCHEMBL4716770;DTXSID20298866;ZINC1715284;AKOS006292497;NSC-126610
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CAS No:
3-(4-chlorophenyl)-3-oxopropanoic acid Basic Attributes
198.60 g/mol
198.0083718 g/mol
126610
DTXSID20298866
3-(4-chlorophenyl)-3-oxopropanoic acid Use and Manufacturing
Environmental transformation -> Pesticide transformation products (metabolite, successor)
Valifenalate metabolite Prop.2 is a known environmental transformation product of Valifenalate.
Computed Properties
Molecular Weight:198.60
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:198.0083718
Monoisotopic Mass:198.0083718
Topological Polar Surface Area:54.4
Heavy Atom Count:13
Complexity:207
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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