ChemSpider 2D Image | 2-Chloro-N-(3-(methylthio)phenyl)pyrimidin-4-amine | C11H10ClN3S

2-Chloro-N-(3-(methylthio)phenyl)pyrimidin-4-amine

  • Molecular FormulaC11H10ClN3S
  • Average mass251.735 Da
  • Monoisotopic mass251.028397 Da
  • ChemSpider ID28601150

More details:

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

1248815-62-4 [RN]
2-Chlor-N-[3-(methylsulfanyl)phenyl]-4-pyrimidinamin [German] [ACD/IUPAC Name]
2-Chloro-N-(3-(methylthio)phenyl)pyrimidin-4-amine
2-Chloro-N-[3-(methylsulfanyl)phenyl]-4-pyrimidinamine [ACD/IUPAC Name]
2-Chloro-N-[3-(méthylsulfanyl)phényl]-4-pyrimidinamine [French] [ACD/IUPAC Name]
4-Pyrimidinamine, 2-chloro-N-[3-(methylthio)phenyl]- [ACD/Index Name]
2-chloro-N-(3-methylsulfanylphenyl)pyrimidin-4-amine
2-CHLORO-N-[3-(METHYLSULFANYL)PHENYL]PYRIMIDIN-4-AMINE
2-chloro-n-[3-(methylsulfanyl)phenyl]pyrimidin-4-amine(wx636046)
AGN-PC-0DLQCH
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 449.8±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.8±3.0 kJ/mol
    Flash Point: 225.8±23.2 °C
    Index of Refraction: 1.658
    Molar Refractivity: 68.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 3.30
    ACD/BCF (pH 5.5): 190.82
    ACD/KOC (pH 5.5): 1492.92
    ACD/LogD (pH 7.4): 3.30
    ACD/BCF (pH 7.4): 190.90
    ACD/KOC (pH 7.4): 1493.51
    Polar Surface Area: 63 Å2
    Polarizability: 27.0±0.5 10-24cm3
    Surface Tension: 64.6±5.0 dyne/cm
    Molar Volume: 185.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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