Found 1 result

Search term: JAXIFLBRKIYZKE-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 4-[(4-Chlorobenzyl)amino]-3-nitrobenzoic acid | C14H11ClN2O4

4-[(4-Chlorobenzyl)amino]-3-nitrobenzoic acid

  • Molecular FormulaC14H11ClN2O4
  • Average mass306.701 Da
  • Monoisotopic mass306.040741 Da
  • ChemSpider ID22235868

More details:






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

4-[(4-Chlorbenzyl)amino]-3-nitrobenzoesäure [German] [ACD/IUPAC Name]
4-[(4-Chlorobenzyl)amino]-3-nitrobenzoic acid [ACD/IUPAC Name]
Acide 4-[(4-chlorobenzyl)amino]-3-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(4-chlorophenyl)methyl]amino]-3-nitro- [ACD/Index Name]
309943-02-0 [RN]
4-{[(4-Chlorophenyl)methyl]amino}-3-nitrobenzoic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 499.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 256.1±28.7 °C
Index of Refraction: 1.690
Molar Refractivity: 78.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 84.00
ACD/KOC (pH 5.5): 315.29
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 2.86
ACD/KOC (pH 7.4): 10.74
Polar Surface Area: 95 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 68.2±3.0 dyne/cm
Molar Volume: 205.9±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement