[3,4,5-Triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate

HCID 5201201

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Grundinformationen

CAS: 6047-47-8
Standard-SMILES: CC(=O)OCC1OC(OC(=N)C(Cl)(Cl)Cl)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
InChIKey: IBUZGVQIKARDAF-UHFFFAOYSA-N
Summenformel: C16H20Cl3NO10
Durchschnittliche Molmasse: 492,7 g/mol
Monoisotopische Masse: 491,01527888

Namen und Bezeichner

Bevorzugter Name: [3,4,5-Triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate
IUPAC: [3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate

Namen und Synonyme

2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl trichloroacetimidate158250-57-86047-47-8Tetra-O-acetyl-alpha-D-glucose trichloroacetimidateC16H20Cl3NO10[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate[3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate2,3,4,6-Tetra-O-acetyl-a-D-mannopyranosyl trichloroacetimidateD-Glucopyranose, 2,3,4,6-tetraacetate 1-(2,2,2-trichloroethanimidate)SCHEMBL10062339DTXSID009758802,3,4,6-Tetra-O-acetyl-1-O-trichloroacetimidoyl-D-mannopyranose

Weitere Namen anzeigen

MT014422,3,4,6-Tetra-O-acetyl-1-O-(2,2,2-trichloroethanimidoyl)hexopyranose2,3,4,6-Tetra-O-acetyl-a-D-galactopyranosyl 2,2,2-trichloroacetimidate2,3,4,6-Tetra-O-acetyl-b-D-glucopyranosyl 2,2,2-trichloroacetimidatea-D-Glucopyranose,2,3,4,6-tetraacetate 1-(2,2,2-trichloroethanimidate)[3,4,5-triacetoxy-6-(2,2,2-trichloroethanimidoyl)oxy-tetrahydropyran-2-yl]methyl acetate[3,4,5-triacetyloxy-6-[2,2,2-tris(chloranyl)ethanimidoyloxy]oxan-2-yl]methyl ethanoate

Datenbank-Bezeichner

CAS: 6047-47-8
PubChem CID: 5201201
DTXSID: DTXSID00975880

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,6
Polarare Oberfläche (TPSA): 148 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 11
Frei drehbare Bindungen: 11
Schwere Atome: 30
Formalladung: 0
Komplexität: 695

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HRID 95236als EduktTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

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