ChemSpider 2D Image | 23-(Dimethylamino)-8,12,22,24-tetrahydroxy-4,10-dimethoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.0~2,19~.0~5,18~.0~7,16~.0~9,14~]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione | C29H33NO10

23-(Dimethylamino)-8,12,22,24-tetrahydroxy-4,10-dimethoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione

  • Molecular FormulaC29H33NO10
  • Average mass555.573 Da
  • Monoisotopic mass555.210449 Da
  • ChemSpider ID293344

More details:

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

2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione, 4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,10,13-tetrahydroxy-8,11-dimethoxy-6,13-dimethyl- [ACD/Index Name]
23-(Dimethylamino)-8,12,22,24-tetrahydroxy-4,10-dimethoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaen-6,17-dion [German] [ACD/IUPAC Name]
23-(Dimethylamino)-8,12,22,24-tetrahydroxy-4,10-dimethoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione [ACD/IUPAC Name]
23-(Diméthylamino)-8,12,22,24-tétrahydroxy-4,10-diméthoxy-1,12-diméthyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaène-6,17-dione [French] [ACD/IUPAC Name]
4, 7-Condi-O-methylnogarol
NOGAROL, 4,7-CONDI-O-METHYL

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

NSC321248 [DBID]
U-59952 [DBID]
U-59992 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 806.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.0±3.0 kJ/mol
Flash Point: 441.7±34.3 °C
Index of Refraction: 1.688
Molar Refractivity: 139.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 14.73
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 8.49
ACD/KOC (pH 7.4): 76.75
Polar Surface Area: 155 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 81.2±5.0 dyne/cm
Molar Volume: 364.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement