Found 16 results

Search term: MF = 'C_{17}H_{19}N_{2}O_{4}P'
ChemSpider 2D Image | (11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoline-9,10-diol 3-oxide | C17H19N2O4P

(11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoline-9,10-diol 3-oxide

  • Molecular FormulaC17H19N2O4P
  • Average mass346.318 Da
  • Monoisotopic mass346.108246 Da
  • ChemSpider ID62547522

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(11bR) 3-Oxyde de 3-benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoléine-9,10-diol [French] [ACD/IUPAC Name]
(11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isochinolin-9,10-diol-3-oxid [German] [ACD/IUPAC Name]
(11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoline-9,10-diol 3-oxide [ACD/IUPAC Name]
(3S,11bR) 3-Oxyde de 3-benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoléine-9,10-diol [French] [ACD/IUPAC Name]
(3S,11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isochinolin-9,10-diol-3-oxid [German] [ACD/IUPAC Name]
(3S,11bR)-3-Benzyl-1,3,4,6,7,11b-hexahydro[1,3,4,2]oxadiazaphosphinino[5,4-a]isoquinoline-9,10-diol 3-oxide [ACD/IUPAC Name]
[1,3,4,2]Oxadiazaphosphorino[5,4-a]isoquinoline-9,10-diol, 1,3,4,6,7,11b-hexahydro-3-(phenylmethyl)-, 3-oxide, (11bR)- [ACD/Index Name]
[1,3,4,2]Oxadiazaphosphorino[5,4-a]isoquinoline-9,10-diol, 1,3,4,6,7,11b-hexahydro-3-(phenylmethyl)-, 3-oxide, (3S,11bR)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 556.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 290.4±32.9 °C
Index of Refraction: 1.689
Molar Refractivity: 89.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 92 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 234.6±5.0 cm3

Click to predict properties on the Chemicalize site


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