ChemSpider 2D Image | N-Methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)glycine | C9H8N4O5

N-Methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)glycine

  • Molecular FormulaC9H8N4O5
  • Average mass252.184 Da
  • Monoisotopic mass252.049469 Da
  • ChemSpider ID28682548

More details:

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

137718-44-6 [RN]
2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]acetic acid
Glycine, N-methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)- [ACD/Index Name]
N-Methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)glycin [German] [ACD/IUPAC Name]
N-Methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)glycine [ACD/IUPAC Name]
N-Méthyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)glycine [French] [ACD/IUPAC Name]
[METHYL(7-NITRO-2,1,3-BENZOXADIAZOL-4-YL)AMINO]ACETIC ACID
2-(Methyl(7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)acetic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 517.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 266.6±32.9 °C
Index of Refraction: 1.703
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.28
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.71
ACD/LogD (pH 7.4): -2.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 89.2±3.0 dyne/cm
Molar Volume: 153.8±3.0 cm3

Click to predict properties on the Chemicalize site


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