ChemSpider 2D Image | 2-{[(4-Bromo-2-thienyl)methyl]amino}-1-butanol | C9H14BrNOS

2-{[(4-Bromo-2-thienyl)methyl]amino}-1-butanol

  • Molecular FormulaC9H14BrNOS
  • Average mass264.183 Da
  • Monoisotopic mass262.997925 Da
  • ChemSpider ID21857382

More details:

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

1-Butanol, 2-[[(4-bromo-2-thienyl)methyl]amino]- [ACD/Index Name]
2-{[(4-Brom-2-thienyl)methyl]amino}-1-butanol [German] [ACD/IUPAC Name]
2-{[(4-Bromo-2-thienyl)methyl]amino}-1-butanol [ACD/IUPAC Name]
2-{[(4-Bromo-2-thiényl)méthyl]amino}-1-butanol [French] [ACD/IUPAC Name]
2-{[(4-Bromo-2-thienyl)methyl]amino}butan-1-ol
1040313-82-3 [RN]
2-[(4-Bromo-thiophen-2-ylmethyl)-amino]-butan-1-ol
2-{[(4-bromothiophen-2-yl)methyl]amino}butan-1-ol
MFCD11175390

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

Density: 1.4±0.1 g/cm3
Boiling Point: 363.9±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 173.9±25.1 °C
Index of Refraction: 1.575
Molar Refractivity: 60.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.38
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 9.32
ACD/KOC (pH 7.4): 118.50
Polar Surface Area: 61 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 184.1±3.0 cm3

Click to predict properties on the Chemicalize site


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