Found 4819 results

Search term: MF = 'C_{12}H_{22}N_{2}O_{4}S'
ChemSpider 2D Image | 2-Methyl-2-propanyl octahydro-6H-[1,2]thiazolo[4,5-d]azepine-6-carboxylate 1,1-dioxide | C12H22N2O4S

2-Methyl-2-propanyl octahydro-6H-[1,2]thiazolo[4,5-d]azepine-6-carboxylate 1,1-dioxide

  • Molecular FormulaC12H22N2O4S
  • Average mass290.379 Da
  • Monoisotopic mass290.130035 Da
  • ChemSpider ID28600842

More details:

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

1,1-Dioxyde de octahydro-6H-[1,2]thiazolo[4,5-d]azépine-6-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1251003-16-3 [RN]
2-Methyl-2-propanyl octahydro-6H-[1,2]thiazolo[4,5-d]azepine-6-carboxylate 1,1-dioxide [ACD/IUPAC Name]
2-Methyl-2-propanyl-octahydro-6H-[1,2]thiazolo[4,5-d]azepin-6-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
6H-Isothiazolo[4,5-d]azepine-6-carboxylic acid, octahydro-, 1,1-dimethylethyl ester, 1,1-dioxide [ACD/Index Name]
1,1-Dioxo-octahydro-1l6-isothiazolo[4,5-d]azepine-6-carboxylicacidtert-butylester
1263181-13-0 [RN]
MFCD14581175
MFCD21362258

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

Density: 1.2±0.1 g/cm3
Boiling Point: 413.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.6±3.0 kJ/mol
Flash Point: 203.8±31.5 °C
Index of Refraction: 1.511
Molar Refractivity: 71.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.11
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.64
ACD/KOC (pH 5.5): 49.60
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.64
ACD/KOC (pH 7.4): 49.59
Polar Surface Area: 84 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 239.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement