ChemSpider 2D Image | UNII:5L7915I936 | C18H20ClN3O6S3

UNII:5L7915I936

  • Molecular FormulaC18H20ClN3O6S3
  • Average mass506.016 Da
  • Monoisotopic mass505.020264 Da
  • ChemSpider ID32697854

More details:

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

6-Chlor-2,3-dihydroxy-7,8-dimethoxy-10,20-dimethyl-16,17,18-trithia-10,12,20-triazapentacyclo[12.4.2.01,12.03,11.04,9]icosa-4,6,8-trien-13,19-dion [German] [ACD/IUPAC Name]
6-Chloro-2,3-dihydroxy-7,8-dimethoxy-10,20-dimethyl-16,17,18-trithia-10,12,20-triazapentacyclo[12.4.2.01,12.03,11.04,9]icosa-4,6,8-triene-13,19-dione [ACD/IUPAC Name]
6-Chloro-2,3-dihydroxy-7,8-diméthoxy-10,20-diméthyl-16,17,18-trithia-10,12,20-triazapentacyclo[12.4.2.01,12.03,11.04,9]icosa-4,6,8-triène-13,19-dione [French] [ACD/IUPAC Name]
6H-5,13a-(Iminomethano)-4H,8H-[1,2,3,5]trithiazocino[5',4':1,5]pyrrolo[2,3-b]indole-6,14-dione, 11-chloro-5,7a,12b,13-tetrahydro-12b,13-dihydroxy-9,10-dimethoxy-8,15-dimethyl- [ACD/Index Name]
UNII:5L7915I936
7051-84-5 [RN]
SPORIDESMIN C

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

Density: 1.8±0.1 g/cm3
Boiling Point: 824.3±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 452.3±37.1 °C
Index of Refraction: 1.796
Molar Refractivity: 121.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 20.94
ACD/KOC (pH 5.5): 307.07
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.94
ACD/KOC (pH 7.4): 307.07
Polar Surface Area: 179 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 102.1±5.0 dyne/cm
Molar Volume: 285.0±5.0 cm3

Click to predict properties on the Chemicalize site


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