Found 2 results

Search term: MF = 'C_{49}H_{78}N_{8}O_{12}'
ChemSpider 2D Image | 8-sec-Butyl-28-ethyl-2,14-diisopropyl-17-(4-methoxybenzyl)-7,13,16,20,22,22,25,29-octamethyl-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone | C49H78N8O12

8-sec-Butyl-28-ethyl-2,14-diisopropyl-17-(4-methoxybenzyl)-7,13,16,20,22,22,25,29-octamethyl-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone

  • Molecular FormulaC49H78N8O12
  • Average mass971.190 Da
  • Monoisotopic mass970.573914 Da
  • ChemSpider ID164726

More details:

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

1-Oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone, 28-ethyl-17-[(4-methoxyphenyl)methyl]-7,13,16,20,22,22,25,29-octamethyl-2,14-bis(1-methylethyl)-8-(1-methylpropyl )- [ACD/Index Name]
8-sec-Butyl-28-ethyl-2,14-diisopropyl-17-(4-methoxybenzyl)-7,13,16,20,22,22,25,29-octamethyl-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontan-3,6,9,12,15,18,21,23,26,30-decon [German] [ACD/IUPAC Name]
8-sec-Butyl-28-ethyl-2,14-diisopropyl-17-(4-methoxybenzyl)-7,13,16,20,22,22,25,29-octamethyl-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-decone [ACD/IUPAC Name]
8-sec-Butyl-28-éthyl-2,14-diisopropyl-17-(4-méthoxybenzyl)-7,13,16,20,22,22,25,29-octaméthyl-1-oxa-4,7,10,13,16,19,24,27-octaazacyclotriacontane-3,6,9,12,15,18,21,23,26,30-décone [French] [ACD/IUPAC Name]
119264-85-6 [RN]
13952-05-1 [RN]
57-normajusculamide C
8-(BUTAN-2-YL)-28-ETHYL-17-(4-METHOXYBENZYL)-7,13,16,20,22,22,25,29-OCTAMETHYL-2,14-DI(PROPAN-2-YL)-1-OXA-4,7,10,13,16,19,24,27-OCTAAZACYCLOTRIACONTANE-3,6,9,12,15,18,21,23,26,30-DECONE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 1214.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 181.2±3.0 kJ/mol
Flash Point: 688.4±34.3 °C
Index of Refraction: 1.473
Molar Refractivity: 256.2±0.3 cm3
#H bond acceptors: 20
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.17
ACD/LogD (pH 7.4): -0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.17
Polar Surface Area: 259 Å2
Polarizability: 101.6±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 912.6±3.0 cm3

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