Found 954 results

Search term: MF = 'C_{8}H_{6}ClN_{3}O_{2}'
ChemSpider 2D Image | Methyl 2-chloro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate | C8H6ClN3O2

Methyl 2-chloro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

  • Molecular FormulaC8H6ClN3O2
  • Average mass211.605 Da
  • Monoisotopic mass211.014847 Da
  • ChemSpider ID29775574

More details:

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

1352396-67-8 [RN]
2-Chloro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 2-chloro-, methyl ester [ACD/Index Name]
Methyl 2-chloro-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate [ACD/IUPAC Name]
Methyl-2-chlor-1H-pyrrolo[2,3-d]pyrimidin-5-carboxylat [German] [ACD/IUPAC Name]
2-Chloro-7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid methyl ester
95%
Chemistry 10794
MFCD20923472

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.666
    Molar Refractivity: 51.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.89
    ACD/LogD (pH 5.5): 1.18
    ACD/BCF (pH 5.5): 4.64
    ACD/KOC (pH 5.5): 104.33
    ACD/LogD (pH 7.4): 1.18
    ACD/BCF (pH 7.4): 4.61
    ACD/KOC (pH 7.4): 103.72
    Polar Surface Area: 68 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 70.1±3.0 dyne/cm
    Molar Volume: 138.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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