Found 10 results

Search term: GAKJJSAXUFZQTL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Amino-1-[(3xi)-4-thio-beta-D-threo-pentofuranosyl]-2(1H)-(5-~3~H)pyrimidinone | C9H12TN3O4S

4-Amino-1-[(3ξ)-4-thio-β-D-threo-pentofuranosyl]-2(1H)-(5-3H)pyrimidinone

  • Molecular FormulaC9H12TN3O4S
  • Average mass261.290 Da
  • Monoisotopic mass261.070892 Da
  • ChemSpider ID114394325

  • defined stereocentres - 3 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2(1H)-Pyrimidinone-5-t, 4-amino-1-[(3ξ)-4-thio-β-D-threo-pentofuranosyl]- [ACD/Index Name]
4-Amino-1-[(3ξ)-4-thio-β-D-threo-pentofuranosyl]-2(1H)-(5-3H)pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-[(3ξ)-4-thio-β-D-threo-pentofuranosyl]-2(1H)-(5-3H)pyrimidinone [ACD/IUPAC Name]
4-Amino-1-[(3ξ)-4-thio-β-D-thréo-pentofuranosyl]-2(1H)-(5-3H)pyrimidinone [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 535.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.3±6.0 kJ/mol
Flash Point: 277.4±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.91
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.55
ACD/LogD (pH 7.4): -2.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.61
Polar Surface Area: 145 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement