ChemSpider 2D Image | 3',4'-Dimethoxy-.Alpha.-Php | C18H27NO3

3',4'-Dimethoxy-α-Php

  • Molecular FormulaC18H27NO3
  • Average mass305.412 Da
  • Monoisotopic mass305.199097 Da
  • ChemSpider ID68007009

More details:

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

1-(3,4-Dimethoxyphenyl)-2-(1-pyrrolidinyl)-1-hexanon [German] [ACD/IUPAC Name]
1-(3,4-Dimethoxyphenyl)-2-(1-pyrrolidinyl)-1-hexanone [ACD/IUPAC Name]
1-(3,4-Diméthoxyphényl)-2-(1-pyrrolidinyl)-1-hexanone [French] [ACD/IUPAC Name]
1-Hexanone, 1-(3,4-dimethoxyphenyl)-2-(1-pyrrolidinyl)- [ACD/Index Name]
3',4'-Dimethoxy-α-Php
1850391-74-0 [RN]
CO09A4CNE0

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

Density: 1.1±0.1 g/cm3
Boiling Point: 427.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 212.1±25.9 °C
Index of Refraction: 1.522
Molar Refractivity: 88.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.93
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 24.74
ACD/KOC (pH 7.4): 174.38
Polar Surface Area: 39 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 288.8±3.0 cm3

Click to predict properties on the Chemicalize site


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