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Search term: 13560-49-1 (Found by approved synonym)

ChemSpider 2D Image | Sulfanediyldi-2,1-ethanediyl bis(3-amino-2-butenoate) | C12H20N2O4S

Sulfanediyldi-2,1-ethanediyl bis(3-amino-2-butenoate)

  • Molecular FormulaC12H20N2O4S
  • Average mass288.363 Da
  • Monoisotopic mass288.114380 Da
  • ChemSpider ID21160148

More details:






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

13560-49-1 [RN]
236-946-8 [EINECS]
2-Butenoic acid, 3-amino-, thiodi-2,1-ethanediyl ester [ACD/Index Name]
Bis(3-amino-2-buténoate) de sulfanediyldi-2,1-éthanediyle [French] [ACD/IUPAC Name]
Sulfandiyldi-2,1-ethandiyl-bis(3-amino-2-butenoat) [German] [ACD/IUPAC Name]
Sulfanediyldi-2,1-ethanediyl bis(3-amino-2-butenoate) [ACD/IUPAC Name]
2-[2-[(E)-3-aminobut-2-enoyl]oxyethylsulfanyl]ethyl (E)-3-aminobut-2-enoate
Advastab A 70
thiodiethane-1,2-diyl bis(3-aminobut-2-enoate)
THIODIGLYCOL BIS(3-AMINOCROTONATE)

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

Density: 1.2±0.1 g/cm3
Boiling Point: 478.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 243.2±27.3 °C
Index of Refraction: 1.542
Molar Refractivity: 76.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.56
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.18
ACD/KOC (pH 5.5): 30.48
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.80
ACD/KOC (pH 7.4): 72.36
Polar Surface Area: 130 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 241.7±3.0 cm3

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