5-ethyl-7-methylnon-3-yne-1,5-diol
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5-ethyl-7-methylnon-3-yne-1,5-diol
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CAS No:
94849-63-5
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Formula:
C12H22O2
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Chemical Name:
5-ethyl-7-methylnon-3-yne-1,5-diol
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Synonyms:
3-Methyl-5-ethyl-6-nonyn-5,9-diol;94849-63-5;BRN 5497236;5-Ethyl-7-methyl-3-nonyne-1,5-diol;5-ethyl-7-methylnon-3-yne-1,5-diol;3-NONYNE-1,5-DIOL, 5-ETHYL-7-METHYL-;DTXSID30915279
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CAS No:
Computed Properties
Molecular Weight:198.30
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:198.161979940
Monoisotopic Mass:198.161979940
Topological Polar Surface Area:40.5
Heavy Atom Count:14
Complexity:211
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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