ChemSpider 2D Image | Methyl {2-nitro-4-[(1Z)-4-oxo-7,10,13,16-tetraoxa-2,3-diazaheptadec-1-en-1-yl]phenoxy}acetate | C20H29N3O10

Methyl {2-nitro-4-[(1Z)-4-oxo-7,10,13,16-tetraoxa-2,3-diazaheptadec-1-en-1-yl]phenoxy}acetate

  • Molecular FormulaC20H29N3O10
  • Average mass471.458 Da
  • Monoisotopic mass471.185303 Da
  • ChemSpider ID102694500
  • Double-bond stereo - Double-bond stereo


More details:






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

{2-Nitro-4-[(1Z)-4-oxo-7,10,13,16-tétraoxa-2,3-diazaheptadéc-1-én-1-yl]phénoxy}acétate de méthyle [French] [ACD/IUPAC Name]
2,5,8,11-Tetraoxatetradecan-14-oic acid, 2-[(1Z)-[4-(2-methoxy-2-oxoethoxy)-3-nitrophenyl]methylene]hydrazide [ACD/Index Name]
Methyl {2-nitro-4-[(1Z)-4-oxo-7,10,13,16-tetraoxa-2,3-diazaheptadec-1-en-1-yl]phenoxy}acetate [ACD/IUPAC Name]
Methyl-{2-nitro-4-[(1Z)-4-oxo-7,10,13,16-tetraoxa-2,3-diazaheptadec-1-en-1-yl]phenoxy}acetat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.522
Molar Refractivity: 113.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 0.09
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.02
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.02
Polar Surface Area: 160 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 372.3±7.0 cm3

Click to predict properties on the Chemicalize site






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