Benzoic acid, 4-(1,1-dimethylethyl)-, 1-carboxyethyl ester (9CI)
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Benzoic acid, 4-(1,1-dimethylethyl)-, 1-carboxyethyl ester (9CI)
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CAS No:
177664-56-1
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Formula:
C14H18O4
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Chemical Name:
Benzoic acid, 4-(1,1-dimethylethyl)-, 1-carboxyethyl ester (9CI)
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Synonyms:
2-{[4-(2-Methyl-2-propanyl)benzoyl]oxy}propanoic acid;SCHEMBL697849;2-(4-tert-butylbenzoyl)oxypropanoic acid
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CAS No:
Computed Properties
Molecular Weight:250.29
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:250.12050905
Monoisotopic Mass:250.12050905
Topological Polar Surface Area:63.6
Heavy Atom Count:18
Complexity:308
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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