Benzoic acid, 4-(3-hydroxy-1-methylpropyl)-, 1,1-dimethylethyl ester (9CI)
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Benzoic acid, 4-(3-hydroxy-1-methylpropyl)-, 1,1-dimethylethyl ester (9CI)
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CAS No:
149325-57-5
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Formula:
C15H22O3
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Chemical Name:
Benzoic acid, 4-(3-hydroxy-1-methylpropyl)-, 1,1-dimethylethyl ester (9CI)
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Synonyms:
2-Methyl-2-propanyl 4-(4-hydroxy-2-butanyl)benzoate;Tert-butyl 4-(4-hydroxybutan-2-yl)benzoate;SCHEMBL8566225
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CAS No:
Benzoic acid, 4-(3-hydroxy-1-methylpropyl)-, 1,1-dimethylethyl ester (9CI) Basic Attributes
250.33338
250.157
Computed Properties
Molecular Weight:250.33
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:250.15689456
Monoisotopic Mass:250.15689456
Topological Polar Surface Area:46.5
Heavy Atom Count:18
Complexity:259
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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