Found 260 results

Search term: MF = 'C_{27}H_{29}NO_{3}S'
ChemSpider 2D Image | 1-[2-(3,4-Dimethoxyphenyl)-1-pyrrolidinyl]-2-[(diphenylmethyl)sulfanyl]ethanone | C27H29NO3S

1-[2-(3,4-Dimethoxyphenyl)-1-pyrrolidinyl]-2-[(diphenylmethyl)sulfanyl]ethanone

  • Molecular FormulaC27H29NO3S
  • Average mass447.589 Da
  • Monoisotopic mass447.186829 Da
  • ChemSpider ID30053433

More details:

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

1-[2-(3,4-Dimethoxyphenyl)-1-pyrrolidinyl]-2-[(diphenylmethyl)sulfanyl]ethanon [German] [ACD/IUPAC Name]
1-[2-(3,4-Dimethoxyphenyl)-1-pyrrolidinyl]-2-[(diphenylmethyl)sulfanyl]ethanone [ACD/IUPAC Name]
1-[2-(3,4-Diméthoxyphényl)-1-pyrrolidinyl]-2-[(diphénylméthyl)sulfanyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-[(diphenylmethyl)thio]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 596.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.8±30.1 °C
Index of Refraction: 1.607
Molar Refractivity: 130.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.80
ACD/LogD (pH 5.5): 5.27
ACD/BCF (pH 5.5): 5940.41
ACD/KOC (pH 5.5): 17494.01
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5940.41
ACD/KOC (pH 7.4): 17494.01
Polar Surface Area: 64 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 378.2±3.0 cm3

Click to predict properties on the Chemicalize site


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