Found 1 result

Search term: BGGIPVPHBWWEJT-SNVBAGLBSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (1S)-1,2,3,4-Tetrahydro-1-isoquinolinylmethanol | C10H13NO

(1S)-1,2,3,4-Tetrahydro-1-isoquinolinylmethanol

  • Molecular FormulaC10H13NO
  • Average mass163.216 Da
  • Monoisotopic mass163.099716 Da
  • ChemSpider ID29783732

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1,2,3,4-Tetrahydro-1-isochinolinylmethanol [German] [ACD/IUPAC Name]
(1S)-1,2,3,4-Tétrahydro-1-isoquinoléinylméthanol [French] [ACD/IUPAC Name]
(1S)-1,2,3,4-Tetrahydro-1-isoquinolinylmethanol [ACD/IUPAC Name]
[(1s)-1,2,3,4-Tetrahydroisoquinolin-1-Yl]methanol
1-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, (1S)- [ACD/Index Name]
(1S)-1,2,3,4-tetrahydroisoquinolin-1-ylmethanol
68N
872986-64-6 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 306.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 146.0±14.4 °C
Index of Refraction: 1.549
Molar Refractivity: 48.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.70
ACD/LogD (pH 5.5): -1.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.59
Polar Surface Area: 32 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 150.9±3.0 cm3

Click to predict properties on the Chemicalize site


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