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Search term: InChIKey=KFZLIRUEFHTLEW-ZGFVZBPKSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-Geranylthiouridine | C19H28N2O5S

2-Geranylthiouridine

  • Molecular FormulaC19H28N2O5S
  • Average mass396.501 Da
  • Monoisotopic mass396.171906 Da
  • ChemSpider ID28290380
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres


More details:






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

2-{[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]sulfanyl}-1-(β-D-ribofuranosyl)-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
2-{[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]sulfanyl}-1-(β-D-ribofuranosyl)-4(1H)-pyrimidinone [ACD/IUPAC Name]
2-{[(2E)-3,7-Diméthyl-2,6-octadién-1-yl]sulfanyl}-1-(β-D-ribofuranosyl)-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
2-Geranylthiouridine
4(1H)-Pyrimidinone, 2-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]thio]-1-β-D-ribofuranosyl- [ACD/Index Name]
1401688-09-2 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 591.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.3±6.0 kJ/mol
Flash Point: 311.8±32.9 °C
Index of Refraction: 1.600
Molar Refractivity: 104.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.52
ACD/KOC (pH 5.5): 259.10
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.52
ACD/KOC (pH 7.4): 259.10
Polar Surface Area: 128 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 304.4±7.0 cm3

Click to predict properties on the Chemicalize site






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