2,3,4,6-Tetra-O-acetyl-α-D-glucopyranosylbromid
alpha-D-Glucopyranosyl bromide, tetraacetate
Grundinformationen
- CAS
572-09-8- Standard-SMILES
CC(=O)OC[C@H]1O[C@H](Br)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
CYAYKKUWALRRPA-RGDJUOJXSA-N- Summenformel
- C14H19BrO9
- Durchschnittliche Molmasse
- 411,2 g/mol
- Monoisotopische Masse
- 410,02124
Namen und Bezeichner
- Bevorzugter Name
- alpha-D-Glucopyranosyl bromide, tetraacetate
- IUPAC
- [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetate
- Lokaler Name
- 2,3,4,6-Tetra-O-acetyl-α-D-glucopyranosylbromid
- Englischer Name
- 2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl bromide
- Summenformel
- C14H19BrO9
- Molmasse
- 411.2
Namen und Synonyme
alpha-D-Glucopyranosyl bromide, tetraacetate.alpha.-D-Glucopyranosyl bromide, tetraacetateRefChem:555624572-09-82,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl bromideAcetobromglucoseacetobromoglucoseAcetobromo-alpha-D-glucosea-acetobromglucoseC14H19BrO92,3,4,6-Tetra-O-acetyl-|A-D-glucopyranosyl bromideMFCD00063254
Weitere Namen anzeigen
2,3,4,6-tetra-o-acetyl-α-d-glucopyranosyl bromide2,3,4,6-Tetra-O-acetyl-α-D-glucopyranosyl Bromideacetobromo-a-d-glucoseAcetobromo-α-D-glucoseA-D-GLUCOPYRANOSYL BROMIDEALPHA-ACETOBROMO-D-GLUCOSETETRA-O-ACETYL-A-D-GLUCOPYRANOSYL BROMIDE
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxan-2-yl]methyl acetateAcetobromo-|A-D-glucoseAcetobromo glucosed-acetobromoglucose[(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-bromooxan-2-yl]methyl acetateETH4010665(2R,3R,4S,5R,6R)-2-(Acetoxymethyl)-6-bromotetrahydro-2H-pyran-3,4,5-triyl triacetateBromo 2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranoside
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,5
- Polarare Oberfläche (TPSA)
- 114 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 9
- Frei drehbare Bindungen
- 9
- Schwere Atome
- 24
- Formalladung
- 0
- Komplexität
- 506
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physikochemische Eigenschaften
- Schmelzpunkt
- 86 · 86-89 °C
- Siedepunkt
- 0.125 · 0.125-30 °C(Press: 0.0005 Torr)
- Dichte
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- Löslichkeit
- Acetontrile (Very Slightly), Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Powder
- Farbe
- White to beige
- Biologische Quelle
- synthetic (organic)
- Wasserlöslichkeit
- decomposes
- Merck
- 14 · 14,60
- BRN
- 96669 · 96669
- Stabilität
- Stable. Combustible. Incompatible with strong oxidizing agents.
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 86.4% (19 of 22) of all reports.
Warning
H315 (13.6%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 22 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information.alpha.-D-Glucopyranosyl bromide, tetraacetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (13.6%)
Sicherheitsdaten
- F
- 8-10-21
- wgk
- -
- hs_code
- 29329985
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 24/25-36-26
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
VerwendenAn Intermediate in synthesis of ∫-glucosides
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