ChemSpider 2D Image | methyl 2-amino-5-tert-butylthiophene-3-carboxylate | C10H15NO2S

methyl 2-amino-5-tert-butylthiophene-3-carboxylate

  • Molecular FormulaC10H15NO2S
  • Average mass213.297 Da
  • Monoisotopic mass213.082352 Da
  • ChemSpider ID13510222

More details:

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

216574-71-9 [RN]
2-Amino-5-(2-méthyl-2-propanyl)-3-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-amino-5-(1,1-dimethylethyl)-, methyl ester [ACD/Index Name]
Methyl 2-amino-5-(2-methyl-2-propanyl)-3-thiophenecarboxylate [ACD/IUPAC Name]
methyl 2-amino-5-tert-butylthiophene-3-carboxylate
Methyl-2-amino-5-(2-methyl-2-propanyl)-3-thiophencarboxylat [German] [ACD/IUPAC Name]
(1-methyl-5-indazolyl)boronic acid
(1-methylindazol-5-yl)boronic acid;1-METHYLINDAZOL-5-BORONIC ACID
methyl 2-amino-5-tert-butyl-thiophene-3-carboxylate
methyl 5-tert-butyl-2-aminothiophene-3-carboxylate

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

  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-34778]
    • Safety:

      20/21/22 Novochemy [NC-34778]
      20/21/36/37/39 Novochemy [NC-34778]
      GHS07; GHS09 Novochemy [NC-34778]
      H332; H403 Novochemy [NC-34778]
      P301+P310; P337+P313 Novochemy [NC-34778]
      Warning Novochemy [NC-34778]
      Xn Novochemy [NC-34778]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 310.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 141.5±27.9 °C
Index of Refraction: 1.548
Molar Refractivity: 59.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 158.94
ACD/KOC (pH 5.5): 1309.92
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 158.94
ACD/KOC (pH 7.4): 1309.93
Polar Surface Area: 81 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 185.8±3.0 cm3

Click to predict properties on the Chemicalize site