ChemSpider 2D Image | [4-(3-{(2Z)-2-[2-(Dimethylamino)-5-nitrobenzylidene]hydrazino}-3-oxopropyl)phenyl]boronic acid | C18H21BN4O5

[4-(3-{(2Z)-2-[2-(Dimethylamino)-5-nitrobenzylidene]hydrazino}-3-oxopropyl)phenyl]boronic acid

  • Molecular FormulaC18H21BN4O5
  • Average mass384.194 Da
  • Monoisotopic mass384.160492 Da
  • ChemSpider ID99265938

  • Double-bond stereo - Double-bond stereo

More details:

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

[4-(3-{(2Z)-2-[2-(Dimethylamino)-5-nitrobenzyliden]hydrazino}-3-oxopropyl)phenyl]borsäure [German] [ACD/IUPAC Name]
[4-(3-{(2Z)-2-[2-(Dimethylamino)-5-nitrobenzylidene]hydrazino}-3-oxopropyl)phenyl]boronic acid [ACD/IUPAC Name]
Acide [4-(3-{(2Z)-2-[2-(diméthylamino)-5-nitrobenzylidène]hydrazino}-3-oxopropyl)phényl]boronique [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-borono-, 2-[(1Z)-[2-(dimethylamino)-5-nitrophenyl]methylene]hydrazide [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.590
Molar Refractivity: 103.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 119.60
ACD/KOC (pH 5.5): 1068.49
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 113.35
ACD/KOC (pH 7.4): 1012.63
Polar Surface Area: 131 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 305.9±7.0 cm3

Click to predict properties on the Chemicalize site


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