(7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
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(7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
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CAS No:
2961-84-4
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Formula:
C14H9NO5
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Chemical Name:
(7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate
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Synonyms:
7-oxocyclohepta-1,3,5-trien-1-yl 4-nitrobenzoate;2961-84-4;Tropolone, p-nitrobenzoate;NSC79555;NCIOpen2_004608;Oprea1_514863;Oprea1_717887;SCHEMBL19475609;DTXSID00291996;4-Nitro-benzoic acid 7-oxo-cyclohepta-1,3,5-trienyl ester;ZINC245198;NSC-79555;STL299899;AKOS001488603;MCULE-4636213061;EU-0038021
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CAS No:
(7-oxocyclohepta-1,3,5-trien-1-yl) 4-nitrobenzoate Basic Attributes
271.22 g/mol
271.04807239 g/mol
79555
DTXSID00291996
Computed Properties
Molecular Weight:271.22
XLogP3:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:271.04807239
Monoisotopic Mass:271.04807239
Topological Polar Surface Area:89.2
Heavy Atom Count:20
Complexity:504
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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