ChemSpider 2D Image | 4-Nitrophenyl hexopyranosyl-(1->4)hexopyranosyl-(1->4)hexopyranoside | C24H35NO18

4-Nitrophenyl hexopyranosyl-(1->4)hexopyranosyl-(1->4)hexopyranoside

  • Molecular FormulaC24H35NO18
  • Average mass625.531 Da
  • Monoisotopic mass625.185425 Da
  • ChemSpider ID3315584

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Nitrophenyl hexopyranosyl-(1->4)hexopyranosyl-(1->4)hexopyranoside [ACD/IUPAC Name]
4-Nitrophenylhexopyranosyl-(1->4)hexopyranosyl-(1->4)hexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside, 4-nitrophenyl O-hexopyranosyl-(1->4)-O-hexopyranosyl-(1->4)- [ACD/Index Name]
Hexopyranosyl-(1->4)hexopyranosyl-(1->4)hexopyranoside de 4-nitrophényle [French] [ACD/IUPAC Name]
106927-48-4 [RN]
2-[(6-{[4,5-DIHYDROXY-2-(HYDROXYMETHYL)-6-(4-NITROPHENOXY)OXAN-3-YL]OXY}-4,5-DIHYDROXY-2-(HYDROXYMETHYL)OXAN-3-YL)OXY]-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
4-Nitrophenyl β-D-cellotrioside
P-NITROPHENYL β-D-CELLOTRIOSIDE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point: 971.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 148.2±3.0 kJ/mol
Flash Point: 541.1±34.3 °C
Index of Refraction: 1.685
Molar Refractivity: 135.5±0.4 cm3
#H bond acceptors: 19
#H bond donors: 10
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -1.88
ACD/LogD (pH 5.5): -2.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 304 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 110.3±5.0 dyne/cm
Molar Volume: 356.4±5.0 cm3

Click to predict properties on the Chemicalize site


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