ChemSpider 2D Image | Ranitidine N-Oxide | C13H22N4O4S

Ranitidine N-Oxide

  • Molecular FormulaC13H22N4O4S
  • Average mass330.403 Da
  • Monoisotopic mass330.136169 Da
  • ChemSpider ID32675211

More details:

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

73857-20-2 [RN]
Amine oxide, dimethyl[[5-[[[2-[[1-(methylamino)-2-nitroethenyl]amino]ethyl]thio]methyl]-2-furanyl]methyl]- [ACD/Index Name]
N-{2-[({5-[(Dimethylnitroryl)methyl]-2-furyl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitro-1,1-ethendiamin [German] [ACD/IUPAC Name]
N-{2-[({5-[(Dimethylnitroryl)methyl]-2-furyl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitro-1,1-ethenediamine [ACD/IUPAC Name]
N-{2-[({5-[(Diméthylnitroryl)méthyl]-2-furyl}méthyl)sulfanyl]éthyl}-N'-méthyl-2-nitro-1,1-éthènediamine [French] [ACD/IUPAC Name]
Ranitidine N-Oxide
N,N-dimethyl-1-[5-[2-[[1-(methylamino)-2-nitro-vinyl]amino]ethylsulfanylmethyl]-2-furyl]methanamine oxide
N-[2-[[[5-[(Dimethyloxidoamino)-methyl]furan-2-yl]methyl]sulphanyl]ethyl]-N'-methyl-2-nitroethene-1,1-diamine (Ranitidine N-Oxide)
N-{2-[({5-[(dimethylnitroryl)methyl]furan-2-yl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitroethene-1,1-diamine
UNII-K131L1Z4KY

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: -1.54
ACD/LogD (pH 5.5): -0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.41
ACD/LogD (pH 7.4): -0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.17
Polar Surface Area: 125 Å2
Polarizability:
Surface Tension:
Molar Volume:

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