Found 23 results

Search term: MF = 'C_{21}H_{24}N_{2}O_{9}S_{2}'
ChemSpider 2D Image | 2-({2-[(Hydroxy{[hydroxy(4-methoxyphenyl)methyl]sulfanyl}acetyl)amino]ethyl}sulfanyl)ethyl 4-nitrophenyl carbonate | C21H24N2O9S2

2-({2-[(Hydroxy{[hydroxy(4-methoxyphenyl)methyl]sulfanyl}acetyl)amino]ethyl}sulfanyl)ethyl 4-nitrophenyl carbonate

  • Molecular FormulaC21H24N2O9S2
  • Average mass512.553 Da
  • Monoisotopic mass512.092346 Da
  • ChemSpider ID2340517

More details:

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

2-({2-[(Hydroxy{[hydroxy(4-methoxyphenyl)methyl]sulfanyl}acetyl)amino]ethyl}sulfanyl)ethyl 4-nitrophenyl carbonate [ACD/IUPAC Name]
2-({2-[(Hydroxy{[hydroxy(4-methoxyphenyl)methyl]sulfanyl}acetyl)amino]ethyl}sulfanyl)ethyl-4-nitrophenylcarbonat [German] [ACD/IUPAC Name]
Carbonate de 2-({2-[(2-hydroxy-2-{[hydroxy(4-méthoxyphényl)méthyl]sulfanyl}acétyl)amino]éthyl}sulfanyl)éthyle et de 4-nitrophényle [French] [ACD/IUPAC Name]
Carbonic acid, 2-[[2-[[2-hydroxy-2-[[hydroxy(4-methoxyphenyl)methyl]thio]acetyl]amino]ethyl]thio]ethyl 4-nitrophenyl ester [ACD/Index Name]
136743-24-3 [RN]
2-HYDROXY-2-{[HYDROXY(4-METHOXYPHENYL)METHYL]SULFANYL}-N-[2-({2-[(4-NITROPHENOXYCARBONYL)OXY]ETHYL}SULFANYL)ETHYL]ACETAMIDE
4-Mtasnc

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

Density: 1.4±0.1 g/cm3
Boiling Point: 750.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.8±3.0 kJ/mol
Flash Point: 407.6±32.9 °C
Index of Refraction: 1.629
Molar Refractivity: 127.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 141.22
ACD/KOC (pH 5.5): 1203.66
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.18
ACD/KOC (pH 7.4): 1203.35
Polar Surface Area: 211 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 64.0±3.0 dyne/cm
Molar Volume: 359.0±3.0 cm3

Click to predict properties on the Chemicalize site


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