1-Methyl 2-sulfohexanoate
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1-Methyl 2-sulfohexanoate
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CAS No:
67633-91-4
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Formula:
C7H14O5S
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Chemical Name:
1-Methyl 2-sulfohexanoate
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Synonyms:
Hexanoic acid,2-sulfo-,1-methyl ester;1-Methyl 2-sulfohexanoate
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CAS No:
Computed Properties
Molecular Weight:210.25
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:210.05619472
Monoisotopic Mass:210.05619472
Topological Polar Surface Area:89
Heavy Atom Count:13
Complexity:251
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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