ChemSpider 2D Image | compound 3 [PMID: 23134120] | C20H25NO

compound 3 [PMID: 23134120]

  • Molecular FormulaC20H25NO
  • Average mass295.419 Da
  • Monoisotopic mass295.193604 Da
  • ChemSpider ID28667639

More details:

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

3-{2-[(Cyclopropylmethyl)(2-phenylethyl)amino]ethyl}phenol [German] [ACD/IUPAC Name]
3-{2-[(Cyclopropylmethyl)(2-phenylethyl)amino]ethyl}phenol [ACD/IUPAC Name]
3-{2-[(Cyclopropylméthyl)(2-phényléthyl)amino]éthyl}phénol [French] [ACD/IUPAC Name]
compound 3 [PMID: 23134120]
Phenol, 3-[2-[(cyclopropylmethyl)(2-phenylethyl)amino]ethyl]- [ACD/Index Name]
3-[2-[cyclopropylmethyl(2-phenylethyl)amino]ethyl]phenol
HS6666

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

Density: 1.1±0.1 g/cm3
Boiling Point: 456.8±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 226.2±25.4 °C
Index of Refraction: 1.601
Molar Refractivity: 91.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.37
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.51
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 12.59
ACD/KOC (pH 7.4): 62.28
Polar Surface Area: 23 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 267.4±3.0 cm3

Click to predict properties on the Chemicalize site


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