ChemSpider 2D Image | (R)-N-demethylpromethazine | C16H18N2S

(R)-N-demethylpromethazine

  • Molecular FormulaC16H18N2S
  • Average mass270.392 Da
  • Monoisotopic mass270.119080 Da
  • ChemSpider ID32700101

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-N-Methyl-1-(10H-phenothiazin-10-yl)-2-propanamin [German] [ACD/IUPAC Name]
(2R)-N-Methyl-1-(10H-phenothiazin-10-yl)-2-propanamine [ACD/IUPAC Name]
(2R)-N-Méthyl-1-(10H-phénothiazin-10-yl)-2-propanamine [French] [ACD/IUPAC Name]
(R)-N-demethylpromethazine
10H-Phenothiazine-10-ethanamine, N,α-dimethyl-, (αR)- [ACD/Index Name]
146565-76-6 [RN]
37707-23-6 [RN]
N-DEMETHYLPROMETHAZINE
N-DEMETHYLPROMETHAZINE, (R)-
UNII-906QAW7T4F

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

KO6TKA1C4I [DBID]
UNII:KO6TKA1C4I [DBID]
UNII-KO6TKA1C4I [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 410.9±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.3±3.0 kJ/mol
Flash Point: 202.3±25.7 °C
Index of Refraction: 1.620
Molar Refractivity: 83.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 1.16
ACD/KOC (pH 5.5): 5.24
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 9.93
ACD/KOC (pH 7.4): 44.88
Polar Surface Area: 41 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 236.4±3.0 cm3

Click to predict properties on the Chemicalize site


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