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ChemSpider 2D Image | (R)-benserazide | C10H15N3O5

(R)-benserazide

  • Molecular FormulaC10H15N3O5
  • Average mass257.243 Da
  • Monoisotopic mass257.101166 Da
  • ChemSpider ID32797761
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-2-Amino-3-hydroxy-N'-(2,3,4-trihydroxybenzyl)propanehydrazide [ACD/IUPAC Name]
(2R)-2-Amino-3-hydroxy-N'-(2,3,4-trihydroxybenzyl)propanehydrazide [French] [ACD/IUPAC Name]
(2R)-2-Amino-3-hydroxy-N'-(2,3,4-trihydroxybenzyl)propanhydrazid [German] [ACD/IUPAC Name]
(R)-benserazide
212579-80-1 [RN]
(2S)-2-amino-3-hydroxy-N'-(2,3,4-trihydroxybenzyl)propionohydrazide
(2S)-2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide
322-35-0 [RN]
BENSERAZIDE, (R)-
More...

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

2OGJ7AR4XY [DBID]
Lopac-B-7283 [DBID]
NCGC00015163-01 [DBID]
NCGC00016709-01 [DBID]
UNII:2OGJ7AR4XY [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 574.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 301.0±30.1 °C
Index of Refraction: 1.679
Molar Refractivity: 63.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 8
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.03
ACD/LogD (pH 5.5): -3.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.62
Polar Surface Area: 148 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 89.1±3.0 dyne/cm
Molar Volume: 166.9±3.0 cm3

Click to predict properties on the Chemicalize site






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