Found 31 results

Search term: MF = 'C_{20}H_{21}BN_{2}O_{6}'
ChemSpider 2D Image | {3-[2-({3-[(Cyclopropylcarbonyl)amino]benzyl}amino)-2-oxoethoxy]-2-formylphenyl}boronic acid | C20H21BN2O6

{3-[2-({3-[(Cyclopropylcarbonyl)amino]benzyl}amino)-2-oxoethoxy]-2-formylphenyl}boronic acid

  • Molecular FormulaC20H21BN2O6
  • Average mass396.202 Da
  • Monoisotopic mass396.149261 Da
  • ChemSpider ID128659502

More details:

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

{3-[2-({3-[(Cyclopropylcarbonyl)amino]benzyl}amino)-2-oxoethoxy]-2-formylphenyl}boronic acid [ACD/IUPAC Name]
{3-[2-({3-[(Cyclopropylcarbonyl)amino]benzyl}amino)-2-oxoethoxy]-2-formylphenyl}borsäure [German] [ACD/IUPAC Name]
Acide {3-[2-({3-[(cyclopropylcarbonyl)amino]benzyl}amino)-2-oxoéthoxy]-2-formylphényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[2-[[[3-[(cyclopropylcarbonyl)amino]phenyl]methyl]amino]-2-oxoethoxy]-2-formylphenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.625
Molar Refractivity: 102.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 6.02
ACD/KOC (pH 5.5): 125.54
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 3.79
ACD/KOC (pH 7.4): 79.08
Polar Surface Area: 125 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 290.1±5.0 cm3

Click to predict properties on the Chemicalize site


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