ChemSpider 2D Image | 5-(4-Methoxyphenyl)-2-pyrimidinamine | C11H11N3O

5-(4-Methoxyphenyl)-2-pyrimidinamine

  • Molecular FormulaC11H11N3O
  • Average mass201.225 Da
  • Monoisotopic mass201.090210 Da
  • ChemSpider ID21521275

More details:






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

2-Pyrimidinamine, 5-(4-methoxyphenyl)- [ACD/Index Name]
31408-47-6 [RN]
5-(4-Methoxyphenyl)-2-pyrimidinamin [German] [ACD/IUPAC Name]
5-(4-Methoxyphenyl)-2-pyrimidinamine [ACD/IUPAC Name]
5-(4-Méthoxyphényl)-2-pyrimidinamine [French] [ACD/IUPAC Name]
5-(4-Methoxyphenyl)pyrimidin-2-amine
5-(4-Methoxyphenyl)pyrimidin-2-ylamine
MFCD05864795 [MDL number]
(10R,13S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
[31408-47-6] [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-22281]
    • Safety:

      20/21/22 Novochemy [NC-22281]
      20/21/36/37/39 Novochemy [NC-22281]
      GHS07; GHS09 Novochemy [NC-22281]
      H332; H403 Novochemy [NC-22281]
      IRRITANT Matrix Scientific 071796
      P309+P311; P211; P242 Novochemy [NC-22281]
      R52/53 Novochemy [NC-22281]
      Warning Novochemy [NC-22281]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 435.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.2±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 57.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.88
ACD/KOC (pH 5.5): 191.32
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 11.03
ACD/KOC (pH 7.4): 194.00
Polar Surface Area: 61 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 52.8±3.0 dyne/cm
Molar Volume: 167.4±3.0 cm3

Click to predict properties on the Chemicalize site






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