ChemSpider 2D Image | 6-hydroxy-N-methylmyosmine | C10H12N2O

6-hydroxy-N-methylmyosmine

  • Molecular FormulaC10H12N2O
  • Average mass176.215 Da
  • Monoisotopic mass176.094955 Da
  • ChemSpider ID26327654

More details:






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

2(1H)-Pyridinone, 5-(4,5-dihydro-1-methyl-1H-pyrrol-2-yl)- [ACD/Index Name]
5-(1-Methyl-4,5-dihydro-1H-pyrrol-2-yl)-2(1H)-pyridinon [German] [ACD/IUPAC Name]
5-(1-Methyl-4,5-dihydro-1H-pyrrol-2-yl)-2(1H)-pyridinone [ACD/IUPAC Name]
5-(1-Méthyl-4,5-dihydro-1H-pyrrol-2-yl)-2(1H)-pyridinone [French] [ACD/IUPAC Name]
6-hydroxy-N-methylmyosmine
5-(1-methyl-2,3-dihydropyrrol-5-yl)-1H-pyridin-2-one
5-(1-Methyl-4,5-dihydro-1H-pyrrol-2-yl)pyridin-2(1H)-one
5-(4,5-Dihydro-1-methyl-1H-pyrrol-2-yl)-
5-(4,5-Dihydro-1-methyl-1H-pyrrol-2-yl)-2(1H)-pyridinone
5-(N-methyl-4,5-dihydro-1H-pyrrol-2-yl)pyridin-2-ol
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  • Miscellaneous
    • Chemical Class:

      A member of the class of pyrrolines that is <element>N</element>-methyl-2-pyrroline carrying a 6-hydroxypyridin-3-yl substituent at position 2. ChEBI CHEBI:87460

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

Density: 1.2±0.1 g/cm3
Boiling Point: 421.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 208.6±28.7 °C
Index of Refraction: 1.607
Molar Refractivity: 50.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.88
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.30
Polar Surface Area: 36 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 146.9±3.0 cm3

Click to predict properties on the Chemicalize site






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