Mono-2-O-(p-toluenesulfonyl)-b-cyclodextrin hydrate

cas: 84216-71-7 — see every product listed under this CAS number, including other names

Mono-2-O-(p-toluenesulfonyl)-b-cyclodextrin hydrate (CAS 84216-71-7) is a chemical reagent available from Chemat. Available pack sizes: 0,1g, 0,25g, 0,5g, 1g, 2g. Offered by: Biosynth.

brandBiosynth
catalog numberFM62119-0,1g
cas84216-71-7
size0,1g
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properties

categoryCarbohydrates
sub-category 1Cyclodextrins
sub-category 2β-Cyclodextrins
purityNo data
delivery time3-4 weeks
Structural formula: {0} (CAS {1})

[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40S,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,42,43,44,45,46,47,48,49-tridecahydroxy-5,10,15,20,25,30,35-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-41-yl] 4-methylbenzenesulfonate (CAS 84216-71-7) is a chemical compound with the molecular formula C49H76O37S and a molecular weight of 1289.2 g/mol. IUPAC name: [(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40S,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,42,43,44,45,46,47,48,49-tridecahydroxy-5,10,15,20,25,30,35-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-41-yl] 4-methylbenzenesulfonate. InChIKey: VGZWDYWXWGKKEE-UJPGXMRNSA-N.

Identity
Molecular formulaC49H76O37S
Molecular weight1289.2 g/mol
IUPAC name[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40S,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,42,43,44,45,46,47,48,49-tridecahydroxy-5,10,15,20,25,30,35-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-41-yl] 4-methylbenzenesulfonate
InChIKeyVGZWDYWXWGKKEE-UJPGXMRNSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2[C@H]([C@H]3[C@H](O[C@@H]2O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@@H]([C@@H]([C@H]8O)O)O[C@@H]9[C@H](O[C@H](O3)[C@@H]([C@H]9O)O)CO)CO)CO)CO)CO)CO)CO)O

Computed by PubChem (NCBI)

Synonyms: 84216-71-7 (name error), Mono-2-O-(p-toluenesulfonyl)-beta-cyclodextrin, Mono-2-O-(p-toluenesulfonyl)-beta-cyclodextrin Hydrate, Mono-2-O-(p-toluenesulfonyl)-b-cyclodextrin hydrate, orb2939458
Isomers (same molecular formula)
[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecahydroxy-5,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-10-yl]methyl 4-methylbenzenesulfonate C49H76O37S

Also listed as

Mono-2-o-(p-toluenesulfonyl)-beta-cyclodextrin hydrate, 95% Combi-blocks CAS 84216-71-7
Mono–2–O–(p–toluenesulfonyl)–β–cyclodextrin GLPBio CAS 84216-71-7
Mono-2-O-(p-toluenesulfonyl)-beta-cyclodextrin, >97.0%(HPLC) TCI CAS 84216-71-7
Mono-2-O-(p-toluenesulfonyl)-β-cyclodextrin Chemat CAS 84216-71-7