Found 954 results

Search term: MF = 'C_{8}H_{6}ClN_{3}O_{2}'
ChemSpider 2D Image | Methyl 4-chloro-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate | C8H6ClN3O2

Methyl 4-chloro-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate

  • Molecular FormulaC8H6ClN3O2
  • Average mass211.605 Da
  • Monoisotopic mass211.014847 Da
  • ChemSpider ID26000791

More details:

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

4-Chloro-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate de méthyle [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, 4-chloro-, methyl ester [ACD/Index Name]
944709-69-7 [RN]
Methyl 4-chloro-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Methyl-4-chlor-1H-pyrrolo[2,3-d]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
(3-Methylisoxazol-4-yl)methanamine
[944709-69-7] [RN]
4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid methyl ester
4-CHLORO-7H-PYRROLO-[2,3-D]-PYRIMIDINE-6-CARBOXYLIC ACID METHYL ESTER
95%
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    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: 1.45
    ACD/LogD (pH 5.5): 1.28
    ACD/BCF (pH 5.5): 5.52
    ACD/KOC (pH 5.5): 118.19
    ACD/LogD (pH 7.4): 1.27
    ACD/BCF (pH 7.4): 5.43
    ACD/KOC (pH 7.4): 116.26
    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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