ChemSpider 2D Image | N,O-didansyl-L-tyrosine | C33H33N3O7S2

N,O-didansyl-L-tyrosine

  • Molecular FormulaC33H33N3O7S2
  • Average mass647.761 Da
  • Monoisotopic mass647.175964 Da
  • ChemSpider ID393811
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

L-Tyrosine, N,O-bis[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]- [ACD/Index Name]
N,O-Bis{[5-(dimethylamino)-1-naphthyl]sulfonyl}-L-tyrosin [German] [ACD/IUPAC Name]
N,O-Bis{[5-(dimethylamino)-1-naphthyl]sulfonyl}-L-tyrosine [ACD/IUPAC Name]
N,O-Bis{[5-(diméthylamino)-1-naphtyl]sulfonyl}-L-tyrosine [French] [ACD/IUPAC Name]
N,O-didansyl-L-tyrosine
CHEMBL176072
DDT [BSI] [ISO] [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 833.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 127.0±3.0 kJ/mol
Flash Point: 458.1±37.1 °C
Index of Refraction: 1.679
Molar Refractivity: 176.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 7.03
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 35.19
ACD/KOC (pH 5.5): 70.21
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 4.56
ACD/KOC (pH 7.4): 9.09
Polar Surface Area: 150 Å2
Polarizability: 69.8±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 466.6±3.0 cm3

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