ChemSpider 2D Image | (9aS)-2-Amino-9a-methyl-8,9,9a,10-tetrahydrobenzo[g]pteridine-4,6(3H,7H)-dione | C11H13N5O2

(9aS)-2-Amino-9a-methyl-8,9,9a,10-tetrahydrobenzo[g]pteridine-4,6(3H,7H)-dione

  • Molecular FormulaC11H13N5O2
  • Average mass247.253 Da
  • Monoisotopic mass247.106918 Da
  • ChemSpider ID35034591

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(9aS)-2-Amino-9a-methyl-8,9,9a,10-tetrahydrobenzo[g]pteridin-4,6(3H,7H)-dion [German] [ACD/IUPAC Name]
(9aS)-2-Amino-9a-methyl-8,9,9a,10-tetrahydrobenzo[g]pteridine-4,6(3H,7H)-dione [ACD/IUPAC Name]
(9aS)-2-Amino-9a-méthyl-8,9,9a,10-tétrahydrobenzo[g]ptéridine-4,6(3H,7H)-dione [French] [ACD/IUPAC Name]
Benzo[g]pteridine-4,6(3H,7H)-dione, 2-amino-8,9,9a,10-tetrahydro-9a-methyl-, (9aS)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.845
Molar Refractivity: 61.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.88
ACD/LogD (pH 5.5): -2.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 83.3±7.0 dyne/cm
Molar Volume: 138.9±7.0 cm3

Click to predict properties on the Chemicalize site


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