4-OXO-1-PHENYLCYCLOHEXANECARBOXYLICACID
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4-OXO-1-PHENYLCYCLOHEXANECARBOXYLICACID
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CAS No:
75945-91-4
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Formula:
C13H14O3
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Chemical Name:
4-OXO-1-PHENYLCYCLOHEXANECARBOXYLICACID
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Synonyms:
RARECHEM AL BO 1142;4-OXO-1-PHENYLCYCLOHEXANECARBOXYLIC ACID;NSC 400458;1-Phenyl-4-oxocyclohexanecarboxylic acid;4-oxo-1-phenylcyclohexane-1-carboxylic acid;Cyclohexanecarboxylic acid, 4-oxo-1-phenyl-
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CAS No:
4-OXO-1-PHENYLCYCLOHEXANECARBOXYLICACID Basic Attributes
218.25
218.094294304 g/mol
400458
DTXSID30322106
Characteristics
54.4 Ų
1.227±0.06 g/cm3
120-121 °C(Solv: benzene (71-43-2))
408.7±45.0 °C(Predicted)
3.98±0.20
Computed Properties
Molecular Weight:218.25
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:218.094294304
Monoisotopic Mass:218.094294304
Topological Polar Surface Area:54.4
Heavy Atom Count:16
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-OXO-1-PHENYLCYCLOHEXANECARBOXYLICACID
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