4-hydroxy-5-methylsulfonylpentanoic acid
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4-hydroxy-5-methylsulfonylpentanoic acid
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CAS No:
15396-28-8
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Formula:
C6H12O5S
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Chemical Name:
4-hydroxy-5-methylsulfonylpentanoic acid
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Synonyms:
4-Hydroxy-5-(methylsulfonyl)valeric acid;15396-28-8;gamma-Hydroxy-delta-methysulfonyl valeric acid;Valeric acid, 4-hydroxy-5-(methylsulfonyl)-;Pentanoic acid, 4-hydroxy-5-(methylsulfonyl)-;4-hydroxy-5-methylsulfonylpentanoic acid;DTXSID90934880;4-Hydroxy-5-(methanesulfonyl)pentanoic acid
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CAS No:
Computed Properties
Molecular Weight:196.22
XLogP3:-1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:196.04054465
Monoisotopic Mass:196.04054465
Topological Polar Surface Area:100
Heavy Atom Count:12
Complexity:237
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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