ethyl 2-benzoylbutanoate
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ethyl 2-benzoylbutanoate
structure -
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CAS No:
24346-56-3
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Formula:
C13H16O3
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Chemical Name:
ethyl 2-benzoylbutanoate
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Synonyms:
Benzenepropanoic acid, α-ethyl-β-oxo-, ethyl ester; 2-Benzoyl-buttersaeure-aethylester; Aethyl-benzoyl-essigsaeure-aethylester; 2-ethyl-3-phenyl-3-oxopropionic acid ethyl ester; 2-benzoyl-butyric acid ethyl ester;
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:220.26
XLogP3:2.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:220.109944368
Monoisotopic Mass:220.109944368
Topological Polar Surface Area:43.4
Heavy Atom Count:16
Complexity:242
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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