Benzoic acid, 4-Methyl-, 1-Methylpropyl ester
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Benzoic acid, 4-Methyl-, 1-Methylpropyl ester
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CAS No:
100556-51-2
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Formula:
C12H16O2
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Chemical Name:
Benzoic acid, 4-Methyl-, 1-Methylpropyl ester
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Synonyms:
Benzoic acid, 4-methyl-, 1-methylpropyl ester;Sec-butyl 4-methylbenzoate;butan-2-yl 4-methylbenzoate;NSC38139;SCHEMBL92240;100556-51-2;Sec-butyl 4-methylbenzoate #;p-Toluic acid, 2-butyl ester;CTK6C9558;4-Methylbenzoic acid sec-butyl ester
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CAS No:
Computed Properties
Molecular Weight:192.25
XLogP3:3.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:192.115029749
Monoisotopic Mass:192.115029749
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:181
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzoic acid, 4-Methyl-, 1-Methylpropyl ester
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