3-methylbutyl 2-hydroxyoctanoate
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3-methylbutyl 2-hydroxyoctanoate
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CAS No:
6946-75-4
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Formula:
C13H26O3
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Chemical Name:
3-methylbutyl 2-hydroxyoctanoate
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Synonyms:
NSC57357;NSC-57357;DS-013831;3-(4-chloro-3-nitro-phenyl)-N-[(3,5-dibromo-4-hydroxy-phenyl)thiocarbamoyl]prop-2-enamide
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CAS No:
Computed Properties
Molecular Weight:230.34
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:230.18819469
Monoisotopic Mass:230.18819469
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:178
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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