3,4-dihydroxypentyl benzoate
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3,4-dihydroxypentyl benzoate
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CAS No:
35187-72-5
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Formula:
C12H16O4
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Chemical Name:
3,4-dihydroxypentyl benzoate
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Synonyms:
1,4-Dideoxypentitol 5-benzoate;35187-72-5;DTXSID60956635;1-O-Benzoyl-2,5-dideoxypentitol;Pentitol, 1,4-dideoxy-, 5-benzoate
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CAS No:
Computed Properties
Molecular Weight:224.25
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:224.10485899
Monoisotopic Mass:224.10485899
Topological Polar Surface Area:66.8
Heavy Atom Count:16
Complexity:211
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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