ChemSpider 2D Image | N-(2,4,6-Trinitrophenyl)-D-tyrosyl-L-valylglycine | C22H24N6O11

N-(2,4,6-Trinitrophenyl)-D-tyrosyl-L-valylglycine

  • Molecular FormulaC22H24N6O11
  • Average mass548.460 Da
  • Monoisotopic mass548.150330 Da
  • ChemSpider ID169187

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Glycine, N-(2,4,6-trinitrophenyl)-D-tyrosyl-L-valyl- [ACD/Index Name]
N-(2,4,6-Trinitrophenyl)-D-tyrosyl-L-valylglycin [German] [ACD/IUPAC Name]
N-(2,4,6-Trinitrophenyl)-D-tyrosyl-L-valylglycine [ACD/IUPAC Name]
N-(2,4,6-Trinitrophényl)-D-tyrosyl-L-valylglycine [French] [ACD/IUPAC Name]
[(2S)-2-[(2R)-3-(4-HYDROXYPHENYL)-2-[(2,4,6-TRINITROPHENYL)AMINO]PROPANAMIDO]-3-METHYLBUTANAMIDO]ACETIC ACID
114043-34-4 [RN]
2,4,6-trinitrophenyl-tyrosyl-valyl-glycine
Tnp-tyr-val-gly

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

Density: 1.5±0.1 g/cm3
Boiling Point: 922.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.6±3.0 kJ/mol
Flash Point: 511.8±34.3 °C
Index of Refraction: 1.657
Molar Refractivity: 132.3±0.3 cm3
#H bond acceptors: 17
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 3.70
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.50
ACD/LogD (pH 7.4): -1.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 265 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 74.8±3.0 dyne/cm
Molar Volume: 359.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement