2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl 2,2,2-trichloroacetimidate

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Catalog Number
ACM92052294
Product Name
2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl 2,2,2-trichloroacetimidate
Structure
Structure
CAS
92052-29-4
Category
Heterocyclic Organic Compound
Synonyms
[(2S,3R,4S,5S,6S)-3,4,5-triacetoxy-6-(2,2,2-trichloroethanimidoyl)oxy-tetrahydropyran-2-yl]methyl acetate
IUPAC Name
[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate
Molecular Weight
492.69
Molecular Formula
C16H20Cl3NO10
Canonical SMILES
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C)OC(=O)C
InChI
InChI=1S/C16H20Cl3NO10/c1-6(21)25-5-10-11(26-7(2)22)12(27-8(3)23)13(28-9(4)24)14(29-10)30-15(20)16(17,18)19/h10-14,20H,5H2,1-4H3/t10-,11-,12+,13-,14+/m1/s1
InChI Key
IBUZGVQIKARDAF-RGDJUOJXSA-N
Boiling Point
463.3±55.0 °C
Melting Point
154.0-160.0 °C
Density
1.55±0.1 g/ml
Appearance
White powder
Exact Mass
491.01500
H-Bond Acceptor
11
H-Bond Donor
1
pKa
1.39±0.70
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