Benzoic acid, 4-(1-methyl-3-oxopropyl)-, methyl ester (9CI)
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Benzoic acid, 4-(1-methyl-3-oxopropyl)-, methyl ester (9CI)
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CAS No:
240407-05-0
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Formula:
C12H14O3
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Chemical Name:
Benzoic acid, 4-(1-methyl-3-oxopropyl)-, methyl ester (9CI)
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Synonyms:
Methyl 4-(4-oxo-2-butanyl)benzoate
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CAS No:
Computed Properties
Molecular Weight:206.24
XLogP3:2.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:206.094294304
Monoisotopic Mass:206.094294304
Topological Polar Surface Area:43.4
Heavy Atom Count:15
Complexity:217
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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