ChemSpider 2D Image | Zuclopenthixol decanoate | C32H43ClN2O2S

Zuclopenthixol decanoate

  • Molecular FormulaC32H43ClN2O2S
  • Average mass555.214 Da
  • Monoisotopic mass554.273376 Da
  • ChemSpider ID4952942

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{4-[(3Z)-3-(2-Chlor-9H-thioxanthen-9-yliden)propyl]-1-piperazinyl}ethyl-decanoat [German] [ACD/IUPAC Name]
2-{4-[(3Z)-3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl]-1-piperazinyl}ethyl decanoate [ACD/IUPAC Name]
64053-00-5 [RN]
Décanoate de 2-{4-[(3Z)-3-(2-chloro-9H-thioxanthén-9-ylidène)propyl]-1-pipérazinyl}éthyle [French] [ACD/IUPAC Name]
Decanoic acid, 2-(4-(3-(2-chloro-9H-thioxanthen-9-ylidene)propyl)-1-piperazinyl)ethyl ester, (Z)-
Decanoic acid, 2-[4-[(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)propyl]-1-piperazinyl]ethyl ester [ACD/Index Name]
Zuclopenthixol decanoate
(Z)-2-(4-(3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl)piperazin-1-yl)ethyl decanoate
2-(4-(3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl)piperazinyl) decanoate
2-(4-{3-[(9Z)-2-chloro-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethyl decanoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

TSS9KIZ5OG [DBID]
UNII:TSS9KIZ5OG [DBID]
UNII-TSS9KIZ5OG [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 662.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.6±31.5 °C
Index of Refraction: 1.593
Molar Refractivity: 163.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 9.93
ACD/LogD (pH 5.5): 8.74
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 267266.91
ACD/LogD (pH 7.4): 10.13
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 6526647.00
Polar Surface Area: 58 Å2
Polarizability: 64.8±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 481.9±3.0 cm3

Click to predict properties on the Chemicalize site


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