Benzoic acid, 4-(2-methyl-1-oxobutyl)-, ethyl ester (9CI)
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Benzoic acid, 4-(2-methyl-1-oxobutyl)-, ethyl ester (9CI)
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CAS No:
801303-26-4
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Formula:
C14H18O3
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Chemical Name:
Benzoic acid, 4-(2-methyl-1-oxobutyl)-, ethyl ester (9CI)
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Synonyms:
Ethyl 4-(2-methylbutanoyl)benzoate;MFCD27979230;DA-02677;FT-0703443;(+/-)-Ethyl 4-(1-oxo-2-methylbutyl)benzoate;4-(2-methyl-1-oxobutyl)Benzoic acid ethyl ester
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CAS No:
Computed Properties
Molecular Weight:234.29
XLogP3:3.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:234.125594432
Monoisotopic Mass:234.125594432
Topological Polar Surface Area:43.4
Heavy Atom Count:17
Complexity:265
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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