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Search term: 78443216 (Found by CSID)
ChemSpider 2D Image | 4-Amino-7-(5-deoxy-alpha-D-arabinofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | C12H13N5O3

4-Amino-7-(5-deoxy-α-D-arabinofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

  • Molecular FormulaC12H13N5O3
  • Average mass275.263 Da
  • Monoisotopic mass275.101837 Da
  • ChemSpider ID78443216

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

4-Amino-7-(5-deoxy-α-D-arabinofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [ACD/IUPAC Name]
4-Amino-7-(5-desoxy-α-D-arabinofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-5-carbonitril [German] [ACD/IUPAC Name]
4-Amino-7-(5-désoxy-α-D-arabinofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 4-amino-7-(5-deoxy-α-D-arabinofuranosyl)- [ACD/Index Name]
5'-Deoxytoyocamycin

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

Density: 1.8±0.1 g/cm3
Boiling Point: 644.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 343.5±31.5 °C
Index of Refraction: 1.818
Molar Refractivity: 67.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.44
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.72
Polar Surface Area: 130 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 82.0±7.0 dyne/cm
Molar Volume: 154.3±7.0 cm3

Click to predict properties on the Chemicalize site


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