ChemSpider 2D Image | (Isobutyryloxy)methyl 4-chloro-2-[(2-furylmethyl)amino]-5-sulfamoylbenzoate | C17H19ClN2O7S

(Isobutyryloxy)methyl 4-chloro-2-[(2-furylmethyl)amino]-5-sulfamoylbenzoate

  • Molecular FormulaC17H19ClN2O7S
  • Average mass430.860 Da
  • Monoisotopic mass430.060150 Da
  • ChemSpider ID21136657

More details:

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

(Isobutyryloxy)methyl 4-chloro-2-[(2-furylmethyl)amino]-5-sulfamoylbenzoate [ACD/IUPAC Name]
(Isobutyryloxy)methyl-4-chlor-2-[(2-furylmethyl)amino]-5-sulfamoylbenzoat [German] [ACD/IUPAC Name]
4-Chloro-2-[(2-furylméthyl)amino]-5-sulfamoylbenzoate de (isobutyryloxy)méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-, (2-methyl-1-oxopropoxy)methyl ester [ACD/Index Name]
BENZOIC ACID, 5-(AMINOSULFONYL)-4-CHLORO-2-[(2-FURANYLMETHYL)AMINO]-,(2-METHYL-1-OXOPROPOXY)METHYL ESTER

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

Density: 1.4±0.1 g/cm3
Boiling Point: 614.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.1±34.3 °C
Index of Refraction: 1.585
Molar Refractivity: 101.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 132.86
ACD/KOC (pH 5.5): 1152.15
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 131.38
ACD/KOC (pH 7.4): 1139.31
Polar Surface Area: 146 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 301.1±3.0 cm3

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