ChemSpider 2D Image | (S)-bumadizone | C19H22N2O3

(S)-bumadizone

  • Molecular FormulaC19H22N2O3
  • Average mass326.390 Da
  • Monoisotopic mass326.163055 Da
  • ChemSpider ID34989206

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-[(1,2-Diphenylhydrazino)carbonyl]hexanoic acid [ACD/IUPAC Name]
(2S)-2-[(1,2-Diphenylhydrazino)carbonyl]hexansäure [German] [ACD/IUPAC Name]
(S)-bumadizone
Acide (2S)-2-[(1,2-diphénylhydrazino)carbonyl]hexanoïque [French] [ACD/IUPAC Name]
Propanedioic acid, 2-butyl-, mono(1,2-diphenylhydrazide), (2S)- [ACD/Index Name]
222-710-1 [EINECS]
3583-64-0 [RN]
Bumadizone [Wiki]
BUMADIZONE, (S)-
UNII-ATD81G944M

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

U5290W82Q6 [DBID]
UNII:U5290W82Q6 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 487.4±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 248.6±29.3 °C
Index of Refraction: 1.629
Molar Refractivity: 94.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 2.53
ACD/KOC (pH 5.5): 18.50
ACD/LogD (pH 7.4): -0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 70 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 265.9±3.0 cm3

Click to predict properties on the Chemicalize site


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