Cholinium octanoate
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Cholinium octanoate
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CAS No:
71501-52-5
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Formula:
C8H15O2.C5H14NO
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Chemical Name:
Cholinium octanoate
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Synonyms:
Ethanaminium,2-hydroxy-N,N,N-trimethyl-,octanoate (1:1);Ethanaminium,2-hydroxy-N,N,N-trimethyl-,octanoate;Octanoic acid,ion(1-),2-hydroxy-N,N,N-trimethylethanaminium;Choline caprylate;Cholinium octanoate
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CAS No:
Computed Properties
Molecular Weight:247.37
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:247.21474379
Monoisotopic Mass:247.21474379
Topological Polar Surface Area:60.4
Heavy Atom Count:17
Complexity:130
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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