methyl 2-oxo-1-(3-oxobutyl)cycloheptane-1-carboxylate
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methyl 2-oxo-1-(3-oxobutyl)cycloheptane-1-carboxylate
structure -
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CAS No:
191793-22-3
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Formula:
C13H20O4
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Chemical Name:
methyl 2-oxo-1-(3-oxobutyl)cycloheptane-1-carboxylate
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Synonyms:
NSC703175;191793-22-3;CHEMBL2002413;DTXSID40327925;Cycloheptanecarboxylic acid, 2-oxo-1-(3-oxobutyl)-, methyl ester;NSC-703175;NCI60_036892;1-(3-Oxobutyl)-2-oxocycloheptanecarboxylic acid methyl ester
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CAS No:
methyl 2-oxo-1-(3-oxobutyl)cycloheptane-1-carboxylate Basic Attributes
240.29 g/mol
240.13615911 g/mol
703175
DTXSID40327925
Computed Properties
Molecular Weight:240.29
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:240.13615911
Monoisotopic Mass:240.13615911
Topological Polar Surface Area:60.4
Heavy Atom Count:17
Complexity:321
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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