Found 71 results

Search term: MF = 'C_{16}H_{12}BrClN_{2}O_{5}'
ChemSpider 2D Image | Methyl 2-{[(3-bromophenyl)acetyl]amino}-4-chloro-5-nitrobenzoate | C16H12BrClN2O5

Methyl 2-{[(3-bromophenyl)acetyl]amino}-4-chloro-5-nitrobenzoate

  • Molecular FormulaC16H12BrClN2O5
  • Average mass427.634 Da
  • Monoisotopic mass425.961792 Da
  • ChemSpider ID30800732

More details:

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

2-{[2-(3-Bromophényl)acétyl]amino}-4-chloro-5-nitrobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[2-(3-bromophenyl)acetyl]amino]-4-chloro-5-nitro-, methyl ester [ACD/Index Name]
Methyl 2-{[(3-bromophenyl)acetyl]amino}-4-chloro-5-nitrobenzoate [ACD/IUPAC Name]
Methyl-2-{[(3-bromphenyl)acetyl]amino}-4-chlor-5-nitrobenzoat [German] [ACD/IUPAC Name]
199942-77-3 [RN]
methyl 2-(2-(3-bromophenyl)acetamido)-4-chloro-5-nitrobenzoate

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

Density: 1.6±0.1 g/cm3
Boiling Point: 615.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 326.1±31.5 °C
Index of Refraction: 1.656
Molar Refractivity: 95.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.93
ACD/BCF (pH 5.5): 3261.23
ACD/KOC (pH 5.5): 11388.66
ACD/LogD (pH 7.4): 4.93
ACD/BCF (pH 7.4): 3261.13
ACD/KOC (pH 7.4): 11388.30
Polar Surface Area: 101 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 261.1±3.0 cm3

Click to predict properties on the Chemicalize site


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