rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
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rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
structure -
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CAS No:
93940-59-1
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Formula:
C18H34O2
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Chemical Name:
rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
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Synonyms:
Octanoic acid,(1R,2S,5R)-5-ethyl-2-(1-methylethyl)cyclohexyl ester,rel-;Octanoic acid,5-methyl-2-(1-methylethyl)cyclohexyl ester,(1α,2β,5α)-;rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
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CAS No:
rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate Basic Attributes
282.46136
282.46
300-456-3
Computed Properties
Molecular Weight:282.5
XLogP3:6.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:282.255880323
Monoisotopic Mass:282.255880323
Topological Polar Surface Area:26.3
Heavy Atom Count:20
Complexity:273
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
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