Benzoic acid, 4-(1,3-dihydroxy-2,2-dimethylpropyl)-, methyl ester (9CI)
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Benzoic acid, 4-(1,3-dihydroxy-2,2-dimethylpropyl)-, methyl ester (9CI)
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CAS No:
853180-34-4
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Formula:
C13H18O4
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Chemical Name:
Benzoic acid, 4-(1,3-dihydroxy-2,2-dimethylpropyl)-, methyl ester (9CI)
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Synonyms:
Methyl 4-(1,3-dihydroxy-2,2-dimethylpropyl)benzoate
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CAS No:
Benzoic acid, 4-(1,3-dihydroxy-2,2-dimethylpropyl)-, methyl ester (9CI) Basic Attributes
238.27962
238.121
Computed Properties
Molecular Weight:238.28
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:238.12050905
Monoisotopic Mass:238.12050905
Topological Polar Surface Area:66.8
Heavy Atom Count:17
Complexity:254
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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