ChemSpider 2D Image | D-threo-Biopterin | C9H11N5O3

D-threo-Biopterin

  • Molecular FormulaC9H11N5O3
  • Average mass237.215 Da
  • Monoisotopic mass237.086182 Da
  • ChemSpider ID21211028

More details:

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

13019-52-8 [RN]
2-Amino-6-(1,2-dihydroxypropyl)-4(8H)-pteridinon [German] [ACD/IUPAC Name]
2-Amino-6-(1,2-dihydroxypropyl)-4(8H)-pteridinone [ACD/IUPAC Name]
2-Amino-6-(1,2-dihydroxypropyl)-4(8H)-ptéridinone [French] [ACD/IUPAC Name]
4(8H)-Pteridinone, 2-amino-6-(1,2-dihydroxypropyl)- [ACD/Index Name]
D-threo-Biopterin
2-amino-6-[(1R,2R)-1,2-dihydroxypropyl]-4(3H)-pteridinone
6-(D-threo-1,2-dihydroxypropyl)-pterin
dictyopterin
d-threo biopterin
More...

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

Density: 1.9±0.1 g/cm3
Boiling Point: 502.6±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.9±6.0 kJ/mol
Flash Point: 257.7±30.9 °C
Index of Refraction: 1.822
Molar Refractivity: 55.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -2.24
ACD/LogD (pH 5.5): -1.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.35
ACD/LogD (pH 7.4): -1.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.35
Polar Surface Area: 133 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 86.7±7.0 dyne/cm
Molar Volume: 127.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement