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Search term: IYLSLQVYJFYPCO-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3,6,9-Tris(carboxymethyl)-12-octyl-3,6,9,12-tetraazatetradecane-1,14-dioic acid | C24H44N4O10

3,6,9-Tris(carboxymethyl)-12-octyl-3,6,9,12-tetraazatetradecane-1,14-dioic acid

  • Molecular FormulaC24H44N4O10
  • Average mass548.627 Da
  • Monoisotopic mass548.305725 Da
  • ChemSpider ID23115931

More details:

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

3,6,9-Tris(carboxymethyl)-12-octyl-3,6,9,12-tetraazatetradecan-1,14-disäure [German] [ACD/IUPAC Name]
3,6,9-Tris(carboxymethyl)-12-octyl-3,6,9,12-tetraazatetradecane-1,14-dioic acid [ACD/IUPAC Name]
Acide 3,6,9-tris(carboxyméthyl)-12-octyl-3,6,9,12-tétraazatétradécane-1,14-dioïque [French] [ACD/IUPAC Name]
(Carboxymethyl-{2-[carboxymethyl-(2-{carboxymethyl-[2-(carboxymethyl-octyl-amino)-ethyl]-amino}-ethyl)-amino]-ethyl}-amino)-acetic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 763.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 121.0±6.0 kJ/mol
Flash Point: 415.6±32.9 °C
Index of Refraction: 1.550
Molar Refractivity: 135.9±0.3 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 3
ACD/LogP: 4.55
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 199 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 426.8±3.0 cm3

Click to predict properties on the Chemicalize site


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