Chemical Properties of .beta.-D-Glucopyranoside, 4-(acetyloxy)phenyl, tetraacetate (CAS 14698-56-7)

.beta.-D-Glucopyranoside, 4-(acetyloxy)phenyl, tetraacetate

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InChI
InChI=1S/C22H26O12/c1-11(23)28-10-18-19(30-13(3)25)20(31-14(4)26)21(32-15(5)27)22(34-18)33-17-8-6-16(7-9-17)29-12(2)24/h6-9,18-22H,10H2,1-5H3/t18-,19-,20+,21-,22-/m0/s1
InChI Key
XGHWMISYPPWNDJ-CUUWFGFTSA-N
Formula
C22H26O12
SMILES
CC(=O)OCC1OC(Oc2ccc(OC(C)=O)cc2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
Molecular Weight1
482.43
CAS
14698-56-7
Other Names
  • Arbutin, pentaacetate
Sources

Physical Properties

Property Value Unit Source
Δf -1129.97 kJ/mol Joback Calculated Property
Δfgas -1787.61 kJ/mol Joback Calculated Property
Δfus 65.61 kJ/mol Joback Calculated Property
Δvap 119.40 kJ/mol Joback Calculated Property
logPoct/wat 1.07 Crippen Calculated Property
Pc 1334.91 kPa Joback Calculated Property
Tboil 1166.11 K Joback Calculated Property
Tc 1429.21 K Joback Calculated Property
Tfus 776.66 K Joback Calculated Property
Vc 1.25 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1143.09 J/mol×K 1166.11 Joback Calculated Property
η 0.00 Pa×s 1166.11 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 6
-O- (ring) 1
>C=O (nonring) 5
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
-CH3 5
>CH- (ring) 5

Similar Compounds

Galactopyranoside, p-nitrophenyl, tetraacetate, beta-d-. Vanillin, .beta.-D-glucopyranoside, TFA. Eugenol, .beta.-D-glucopyranoside, TFA. Pentosyl «beta»-D-glucopyranoside of methyl salicylate, isomer # 2, TFA. Pentosyl «beta»-D-glucopyranoside of methyl salicylate, isomer # 1, TFA. Methyl salicylate, Gly, TFA. Methyl salicylate, Rut, TFA. Scopoletin .beta.-D-glucopyranoside, TFA. Salicin. o-Nitrophenyl-«beta»-D-galactopyranoside. p-Tolyl-«beta»-D-glucuronide, tris(trimethylsilyl) ether, trimethylsilyl ester. 4-Nitrophenyl-«beta»-D-galacturonide, tris(trimethylsilyl) ether, trimethylsilyl ester. 5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2h-chromen-7-yl 6-o-(6-deoxyhexopyranosyl)hexopyranoside. D-Allopyranose, pentakis(trifluoroacetate) (isomer 1). D-(+)-Mannopyranose, pentakis(trifluoroacetate) (isomer 1).

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