4-octadecoxy-4-oxo-2-sulfobutanoic acid
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4-octadecoxy-4-oxo-2-sulfobutanoic acid
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CAS No:
94021-01-9
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Formula:
C22H42O7S
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Chemical Name:
4-octadecoxy-4-oxo-2-sulfobutanoic acid
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Synonyms:
4-(octadecyloxy)-4-oxo-2-sulfobutanoic acid;DTXSID101015651;94021-01-9
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CAS No:
Computed Properties
Molecular Weight:450.6
XLogP3:7.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:22
Exact Mass:450.26512485
Monoisotopic Mass:450.26512485
Topological Polar Surface Area:126
Heavy Atom Count:30
Complexity:540
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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