ChemSpider 2D Image | 1-(4-Hydroxybenzyl)-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydro-8-isoquinoliniumolate | C19H23NO3


  • Molecular FormulaC19H23NO3
  • Average mass313.391 Da
  • Monoisotopic mass313.167786 Da
  • ChemSpider ID95739468

More details:

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

1-(4-Hydroxybenzyl)-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydro-8-isochinoliniumolat [German] [ACD/IUPAC Name]
1-(4-Hydroxybenzyl)-7-méthoxy-2,2-diméthyl-1,2,3,4-tétrahydro-8-isoquinoléiniumolate [French] [ACD/IUPAC Name]
1-(4-Hydroxybenzyl)-7-methoxy-2,2-dimethyl-1,2,3,4-tetrahydro-8-isoquinoliniumolate [ACD/IUPAC Name]
Isoquinolinium, 1,2,3,4-tetrahydro-8-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-2,2-dimethyl-, inner salt [ACD/Index Name]

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

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.91
ACD/LogD (pH 5.5): -1.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.83
ACD/LogD (pH 7.4): -1.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.17
Polar Surface Area: 53 Å2
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site