methyl 3,4,5-trihydroxycyclohexene-1-carboxylate
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methyl 3,4,5-trihydroxycyclohexene-1-carboxylate
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CAS No:
40983-58-2
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Formula:
C8H12O5
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Chemical Name:
methyl 3,4,5-trihydroxycyclohexene-1-carboxylate
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Synonyms:
40983-58-2;methyl 3,4,5-trihydroxycyclohexene-1-carboxylate;METHYL 3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLATE;NSC280656;SCHEMBL1716907;DTXSID40961363;AKOS027439524;AS-0235;MCULE-9592035402;NSC-280656;FT-0672119;NCGC00381357-01!methyl 3,4,5-trihydroxycyclohexene-1-carboxylate
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CAS No:
methyl 3,4,5-trihydroxycyclohexene-1-carboxylate Basic Attributes
188.18 g/mol
188.06847348 g/mol
280656
Computed Properties
Molecular Weight:188.18
XLogP3:-1.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:188.06847348
Monoisotopic Mass:188.06847348
Topological Polar Surface Area:87
Heavy Atom Count:13
Complexity:235
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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