ChemSpider 2D Image | (2R,3R,4S)-4-Amino-2,3-dihydroxyheptanedioic acid | C7H13NO6

(2R,3R,4S)-4-Amino-2,3-dihydroxyheptanedioic acid

  • Molecular FormulaC7H13NO6
  • Average mass207.181 Da
  • Monoisotopic mass207.074280 Da
  • ChemSpider ID25944198

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3R,4S)-4-amino-2,3-dihydroxy-1,7-heptandioic acid
(2R,3R,4S)-4-Amino-2,3-dihydroxyheptandisäure [German] [ACD/IUPAC Name]
(2R,3R,4S)-4-Amino-2,3-dihydroxyheptanedioic acid [ACD/IUPAC Name]
Acide (2R,3R,4S)-4-amino-2,3-dihydroxyheptanedioïque [French] [ACD/IUPAC Name]
L-arabino-Heptaric acid, 4-amino-2,3,4-trideoxy- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 607.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.5±6.0 kJ/mol
Flash Point: 321.0±31.5 °C
Index of Refraction: 1.576
Molar Refractivity: 44.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.54
ACD/LogD (pH 5.5): -4.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 88.9±3.0 dyne/cm
Molar Volume: 133.2±3.0 cm3

Click to predict properties on the Chemicalize site


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