4-(1-hydroxypropylidene)-3,5-dioxocyclohexane-1-carboxylic acid
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4-(1-hydroxypropylidene)-3,5-dioxocyclohexane-1-carboxylic acid
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CAS No:
156217-00-4
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Formula:
C10H12O5
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Chemical Name:
4-(1-hydroxypropylidene)-3,5-dioxocyclohexane-1-carboxylic acid
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Synonyms:
SCHEMBL8099250;ZINC2382742;OC=1CC(CC(C1C(CC)=O)=O)C(=O)O;3-Hydroxy-5-oxo-4-propionylcyclohex-3-enecarboxylic acid;3-Hydroxy-4-(1-oxopropyl)-5-oxo-3-cyclohexene-1-carboxylic acid;156217-00-4
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CAS No:
4-(1-hydroxypropylidene)-3,5-dioxocyclohexane-1-carboxylic acid Basic Attributes
212.20 g/mol
212.06847348 g/mol
Computed Properties
Molecular Weight:212.20
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:212.06847348
Monoisotopic Mass:212.06847348
Topological Polar Surface Area:91.7
Heavy Atom Count:15
Complexity:333
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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