Found 44 results

Search term: MF = 'C_{18}H_{25}NO_{10}'
ChemSpider 2D Image | N-Acetyl-2-O-(3-methoxyphenyl)neuraminic acid | C18H25NO10

N-Acetyl-2-O-(3-methoxyphenyl)neuraminic acid

  • Molecular FormulaC18H25NO10
  • Average mass415.392 Da
  • Monoisotopic mass415.147858 Da
  • ChemSpider ID62892079

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

30804-44-5 [RN]
3-Methoxyphenyl (6R)-5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-ulopyranosidonic acid [ACD/IUPAC Name]
3-Methoxyphenyl-(6R)-5-acetamido-3,5-didesoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-ulopyranosidonsäure [German] [ACD/IUPAC Name]
Acide (6R)-5-acétamido-3,5-didésoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-thréo-hex-2-ulopyranosidonique de 3-méthoxyphényle [French] [ACD/IUPAC Name]
D-glycero-D-galacto-2-Nonulopyranosidonic acid, 3-methoxyphenyl 5-(acetylamino)-3,5-dideoxy- [ACD/Index Name]
N-Acetyl-2-O-(3-methoxyphenyl)neuraminic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 803.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.5±3.0 kJ/mol
Flash Point: 439.6±34.3 °C
Index of Refraction: 1.616
Molar Refractivity: 96.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -4.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 175 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 77.8±5.0 dyne/cm
Molar Volume: 277.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement