1,1-Dimethylethyl 3,5,5-trimethylhexanoate
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1,1-Dimethylethyl 3,5,5-trimethylhexanoate
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CAS No:
71436-96-9
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Formula:
C13H26O2
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Chemical Name:
1,1-Dimethylethyl 3,5,5-trimethylhexanoate
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Synonyms:
Hexanoic acid,3,5,5-trimethyl-,1,1-dimethylethyl ester;1,1-Dimethylethyl 3,5,5-trimethylhexanoate;tert-Butyl 3,5,5-trimethylhexanoate
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CAS No:
Computed Properties
Molecular Weight:214.34
XLogP3:4.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:214.193280068
Monoisotopic Mass:214.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:189
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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