1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid
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![1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/469cc9f278e94084a02a8a6d42ee7971.png "1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid")
1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid
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CAS No:
6636-70-0
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Formula:
C6H12O12S3
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Chemical Name:
1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid
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Synonyms:
1,5-Dihydroxy-2-(hydroxy(sulfo)methyl)-2-pentene-1,5-disulfonic acid;6636-70-0;NSC18261;NSC 18261;1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid
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CAS No:
1,5-dihydroxy-2-[hydroxy(sulfo)methyl]pent-2-ene-1,5-disulfonic acid Basic Attributes
372.4 g/mol
371.94908933 g/mol
Computed Properties
Molecular Weight:372.4
XLogP3:-3.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:371.94908933
Monoisotopic Mass:371.94908933
Topological Polar Surface Area:249
Heavy Atom Count:21
Complexity:642
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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