Found 153 results

Search term: MF = 'C_{18}H_{11}ClN_{4}OS'
ChemSpider 2D Image | 2-Chloro-10-phenyl-6H-chromeno[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazepine | C18H11ClN4OS

2-Chloro-10-phenyl-6H-chromeno[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazepine

  • Molecular FormulaC18H11ClN4OS
  • Average mass366.824 Da
  • Monoisotopic mass366.034210 Da
  • ChemSpider ID30438063

More details:

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

2-Chlor-10-phenyl-6H-chromeno[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazepin [German] [ACD/IUPAC Name]
2-Chloro-10-phenyl-6H-chromeno[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazepine [ACD/IUPAC Name]
2-Chloro-10-phényl-6H-chroméno[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazépine [French] [ACD/IUPAC Name]
6H-[1]Benzopyrano[3,4-f][1,2,4]triazolo[3,4-b][1,3,4]thiadiazepine, 2-chloro-10-phenyl- [ACD/Index Name]
1262138-80-6 [RN]
AGN-PC-087KVL
AN-829/42007490
MCULE-8945950668
MolPort-019-791-406
SMEVKAYUPGNAKR-UHFFFAOYSA-N

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 706.4±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 103.3±3.0 kJ/mol
    Flash Point: 381.0±35.7 °C
    Index of Refraction: 1.792
    Molar Refractivity: 99.7±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 1
    ACD/LogP: 5.79
    ACD/LogD (pH 5.5): 4.56
    ACD/BCF (pH 5.5): 1723.63
    ACD/KOC (pH 5.5): 7215.11
    ACD/LogD (pH 7.4): 4.56
    ACD/BCF (pH 7.4): 1723.66
    ACD/KOC (pH 7.4): 7215.22
    Polar Surface Area: 78 Å2
    Polarizability: 39.5±0.5 10-24cm3
    Surface Tension: 64.6±7.0 dyne/cm
    Molar Volume: 235.0±7.0 cm3

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