ChemSpider 2D Image | 5-Acetamido-2,6-anhydro-3,5-dideoxy-3-C-(prop-2'-enyl)-D-glycero-D-galacto-non-2-enonic acid | C14H21NO8

5-Acetamido-2,6-anhydro-3,5-dideoxy-3-C-(prop-2'-enyl)-D-glycero-D-galacto-non-2-enonic acid

  • Molecular FormulaC14H21NO8
  • Average mass331.318 Da
  • Monoisotopic mass331.126709 Da
  • ChemSpider ID24750834

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(6R)-5-Acetamido-3-allyl-2,6-anhydro-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-enonic acid [ACD/IUPAC Name]
(6R)-5-Acetamido-3-allyl-2,6-anhydro-3,5-didesoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-threo-hex-2-enonsäure [German] [ACD/IUPAC Name]
5-(Acetylamino)-2,6-Anhydro-3,5-Dideoxy-3-Prop-2-En-1-Yl-D-Glycero-D-Galacto-Non-2-Enonic Acid
5-Acetamido-2,6-anhydro-3,5-dideoxy-3-C-(prop-2'-enyl)-D-glycero-D-galacto-non-2-enonic acid
Acide (6R)-5-acétamido-3-allyl-2,6-anhydro-3,5-didésoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-thréo-hex-2-énonique [French] [ACD/IUPAC Name]
D-glycero-D-galacto-Non-2-enonic acid, 5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-(2-propen-1-yl)- [ACD/Index Name]

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

Density: 1.5±0.0 g/cm3
Boiling Point: 740.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 123.2±0.0 kJ/mol
Flash Point: 401.5±0.0 °C
Index of Refraction: 1.595
Molar Refractivity: 77.2±0.0 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: -1.76
ACD/LogD (pH 5.5): -3.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 30.6±0.0 10-24cm3
Surface Tension: 73.1±0.0 dyne/cm
Molar Volume: 227.2±0.0 cm3

Click to predict properties on the Chemicalize site


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