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Search term: MF = 'C_{9}H_{12}ClNO_{2}S'

ChemSpider 2D Image | tert-Butyl (4-chlorothiophen-2-yl)carbamate | C9H12ClNO2S

tert-Butyl (4-chlorothiophen-2-yl)carbamate

  • Molecular FormulaC9H12ClNO2S
  • Average mass233.715 Da
  • Monoisotopic mass233.027725 Da
  • ChemSpider ID38773136

More details:






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

(4-Chloro-2-thiényl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1936334-08-5 [RN]
2-Methyl-2-propanyl (4-chloro-2-thienyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4-chlor-2-thienyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(4-chloro-2-thienyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl (4-chlorothiophen-2-yl)carbamate
(4-Chloro-thiophen-2-yl)-carbamic acid t-butyl ester
MFCD29760467
tert-butyl N-(4-chlorothiophen-2-yl)carbamate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 265.4±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.3±3.0 kJ/mol
Flash Point: 114.3±23.2 °C
Index of Refraction: 1.575
Molar Refractivity: 59.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 328.10
ACD/KOC (pH 5.5): 2200.70
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 328.10
ACD/KOC (pH 7.4): 2200.70
Polar Surface Area: 67 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 179.9±3.0 cm3

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