ChemSpider 2D Image | 1-[(2S)-2,3-Dihydro-1,4-benzodioxin-2-ylmethyl]-4-(3-{[(~11~C)methyloxy]methyl}-2-pyridinyl)piperazine | C1911CH25N3O3

1-[(2S)-2,3-Dihydro-1,4-benzodioxin-2-ylmethyl]-4-(3-{[(11C)methyloxy]methyl}-2-pyridinyl)piperazine

  • Molecular FormulaC1911CH25N3O3
  • Average mass354.431 Da
  • Monoisotopic mass354.201019 Da
  • ChemSpider ID52085734

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-[(2S)-2,3-Dihydro-1,4-benzodioxin-2-ylmethyl]-4-(3-{[(11C)methyloxy]methyl}-2-pyridinyl)piperazin [German] [ACD/IUPAC Name]
1-[(2S)-2,3-Dihydro-1,4-benzodioxin-2-ylmethyl]-4-(3-{[(11C)methyloxy]methyl}-2-pyridinyl)piperazine [ACD/IUPAC Name]
1-[(2S)-2,3-Dihydro-1,4-benzodioxin-2-ylméthyl]-4-(3-{[(11C)méthyloxy]méthyl}-2-pyridinyl)pipérazine [French] [ACD/IUPAC Name]
1227170-74-2 [RN]
Piperazine, 1-[[(2S)-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]-4-[3-[(methyl-11C-oxy)methyl]-2-pyridinyl]- [ACD/Index Name]
11C-ORM-13070
ORM-13070 C-11

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

Y61S1UFN4Y [DBID]
UNII:Y61S1UFN4Y [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.582
Molar Refractivity: 99.1±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#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:
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 297.1±3.0 cm3

Click to predict properties on the Chemicalize site


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