methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
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methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
structure -
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CAS No:
33577-98-9
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Formula:
C13H14O3
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Chemical Name:
methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
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CAS No:
methyl 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate Basic Attributes
218.24800
218.094294304 g/mol
DTXSID90346025
2918290000
Computed Properties
Molecular Weight:218.25
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:218.094294304
Monoisotopic Mass:218.094294304
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:311
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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