3-(1,1-Dimethylethyl)-5-methylbenzoic acid
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3-(1,1-Dimethylethyl)-5-methylbenzoic acid
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CAS No:
17484-28-5
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Formula:
C12H16O2
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Chemical Name:
3-(1,1-Dimethylethyl)-5-methylbenzoic acid
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Synonyms:
Benzoic acid,3-(1,1-dimethylethyl)-5-methyl-;m-Toluic acid,5-tert-butyl-;3-(1,1-Dimethylethyl)-5-methylbenzoic acid;3-tert-Butyl-5-methylbenzoic acid
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CAS No:
Characteristics
37.30000
2.99070
1.039g/cm3
163-164 °C
297.7ºC at 760mmHg
142.8ºC
1.521
0.000595mmHg at 25°C
Computed Properties
Molecular Weight:192.25
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:192.115029749
Monoisotopic Mass:192.115029749
Topological Polar Surface Area:37.3
Heavy Atom Count:14
Complexity:215
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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