Found 31 results

Search term: MF = 'C_{20}H_{21}BN_{2}O_{6}'
ChemSpider 2D Image | (4-{3-[(2Z)-2-{2-Hydroxy-5-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]benzylidene}hydrazino]-3-oxopropyl}phenyl)boronic acid | C20H21BN2O6

(4-{3-[(2Z)-2-{2-Hydroxy-5-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]benzylidene}hydrazino]-3-oxopropyl}phenyl)boronic acid

  • Molecular FormulaC20H21BN2O6
  • Average mass396.202 Da
  • Monoisotopic mass396.149261 Da
  • ChemSpider ID99264119

  • Double-bond stereo - Double-bond stereo

More details:

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

(4-{3-[(2Z)-2-{2-Hydroxy-5-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]benzyliden}hydrazino]-3-oxopropyl}phenyl)borsäure [German] [ACD/IUPAC Name]
(4-{3-[(2Z)-2-{2-Hydroxy-5-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]benzylidene}hydrazino]-3-oxopropyl}phenyl)boronic acid [ACD/IUPAC Name]
Acide (4-{3-[(2Z)-2-{2-hydroxy-5-[(1E)-3-méthoxy-3-oxo-1-propén-1-yl]benzylidène}hydrazino]-3-oxopropyl}phényl)boronique [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-borono-, 2-[(1Z)-[2-hydroxy-5-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]phenyl]methylene]hydrazide [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.569
Molar Refractivity: 106.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 94.93
ACD/KOC (pH 5.5): 899.27
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 30.74
ACD/KOC (pH 7.4): 291.22
Polar Surface Area: 128 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 323.8±7.0 cm3

Click to predict properties on the Chemicalize site


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