Found 2758 results

Search term: MF = 'C_{14}H_{18}ClNO_{3}S'
ChemSpider 2D Image | Methyl 2-[(2-chloropropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate | C14H18ClNO3S

Methyl 2-[(2-chloropropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

  • Molecular FormulaC14H18ClNO3S
  • Average mass315.816 Da
  • Monoisotopic mass315.069580 Da
  • ChemSpider ID27444468

More details:

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

2-[(2-Chloropropanoyl)amino]-5,6,7,8-tétrahydro-4H-cyclohepta[b]thiophène-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-Cyclohepta[b]thiophene-3-carboxylic acid, 2-[(2-chloro-1-oxopropyl)amino]-5,6,7,8-tetrahydro-, methyl ester [ACD/Index Name]
Methyl 2-[(2-chloropropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate [ACD/IUPAC Name]
Methyl-2-[(2-chlorpropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-carboxylat [German] [ACD/IUPAC Name]
1156767-73-5 [RN]
methyl 2-(2-chloropropanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Methyl 2-[(2-chloropropanoyl)amino]-5,6,7,8-tetra-hydro-4H-cyclohepta[b]thiophene-3-carboxylate
MFCD13706369 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 521.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.5±3.0 kJ/mol
    Flash Point: 269.1±30.1 °C
    Index of Refraction: 1.587
    Molar Refractivity: 81.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.78
    ACD/LogD (pH 5.5): 3.78
    ACD/BCF (pH 5.5): 439.89
    ACD/KOC (pH 5.5): 2714.61
    ACD/LogD (pH 7.4): 3.78
    ACD/BCF (pH 7.4): 439.88
    ACD/KOC (pH 7.4): 2714.57
    Polar Surface Area: 84 Å2
    Polarizability: 32.3±0.5 10-24cm3
    Surface Tension: 48.6±3.0 dyne/cm
    Molar Volume: 242.7±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement