2,3,4,6-Tetrakis-O-(phenylmethyl)-D-galactopyranose

HCID 2734154CAS 6386-24-9

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Grundinformationen

Standard-SMILES: OC1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
InChIKey: OGOMAWHSXRDAKZ-BJPULKCASA-N
Summenformel: C34H36O6
Durchschnittliche Molmasse: 540,6 g/mol
Monoisotopische Masse: 540,25118887

Namen und Bezeichner

Bevorzugter Name: 2,3,4,6-Tetrakis-O-(phenylmethyl)-D-galactopyranose
IUPAC: (3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-ol
Englischer Name: 2,3,4,6-TETRA-O-BENZYL-D-GALACTOPYRANOSE
Summenformel: C34H36O6
Molmasse: 540.65

Namen und Synonyme

6386-24-92,3,4,6-tetrakis-O-(phenylMethyl)-D-GalactopyranoseDTXSID801224584RefChem:81285DTXCID501655851826-705-02,3,4,6-Tetra-O-benzyl-D-galactopyranoseMFCD00132927(3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-ol2,3,4,6-tetra-O-benzyl-galactopyranoseC34H36O6(3R,4S,5S,6R)-3,4,5-Tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-ol

Weitere Namen anzeigen

TETRA-O-BENZYL-D-GALACTOPYRANOSED-Galactopyranose, 2,3,4,6-tetrakis-O-(phenylmethyl)-

2,3,4,6-Tetra-O-benzyl-D-galactose, >=98%(3R,4S,5S,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-olAMY365012,3,4,6-Tetra-O-benzyl-D-glucopyranose2,3,4,6-Tetra-O-benzyorb2941972SCHEMBL1900721OGOMAWHSXRDAKZ-BJPULKCASA-N

Datenbank-Bezeichner

CAS: 6386-24-9
PubChem CID: 2734154
DTXSID: DTXSID801224584
UNII: M534PC68U7
EC Number: 432-870-6、826-705-0
Nikkaji: J636.109I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 5
Polarare Oberfläche (TPSA): 66,4 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 6
Frei drehbare Bindungen: 13
Schwere Atome: 40
Formalladung: 0
Komplexität: 665

Physikochemische Eigenschaften

Schmelzpunkt: 64 · 64-69°C
Siedepunkt: 672.4 · 672.4±55.0 °C(Predicted)
Dichte: 1.22 · 1.22±0.1 g/cm3(Predicted)
storage temp.: -20 °C · -20°C
Aggregatzustand: powder to crystal
pka: 11.87 · 11.87±0.70(Predicted)
Farbe: White to Almost white
InChIKey: OGOMAWHSXRDAKZ-BJPULKCASA-N
SMILES: OC1O[C@H](COCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.

Warning

H315 (33.3%): 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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning