[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid
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![[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/216d155ee51040eb9ae472b2ae27cc84.png "[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid")
[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid
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CAS No:
151301-57-4
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Formula:
C9H18O9S3
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Chemical Name:
[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid
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Synonyms:
CTMS;cyclohexane-(1R,2R,4R)-tris(methylenesulfonate);cyclohexane-1,2,4-tris(methylenesulfonate);151301-57-4;CTMS;Cyclohexane-1,2,4-tris(methylenesulfonate);Cyclohexane-(1R,2R,4R)-tris(methylenesulfonate);DTXSID70934227;[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid;(Cyclohexane-1,2,4-triyl)trimethanesulfonic acid
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CAS No:
[(1R,3S,4R)-3,4-bis(sulfomethyl)cyclohexyl]methanesulfonic acid Basic Attributes
366.4 g/mol
366.01129567 g/mol
Computed Properties
Molecular Weight:366.4
XLogP3:-1.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:366.01129567
Monoisotopic Mass:366.01129567
Topological Polar Surface Area:188
Heavy Atom Count:21
Complexity:645
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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