ChemSpider 2D Image | 8-Chloro-10-(4-(2-decanoyloxyethyl)piperazino)-10,11-dihydrodibenzo(b,f)thiepin | C30H41ClN2O2S

8-Chloro-10-(4-(2-decanoyloxyethyl)piperazino)-10,11-dihydrodibenzo(b,f)thiepin

  • Molecular FormulaC30H41ClN2O2S
  • Average mass529.177 Da
  • Monoisotopic mass528.257751 Da
  • ChemSpider ID2341850

More details:

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

2-[4-(8-Chlor-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]ethyl-decanoat [German] [ACD/IUPAC Name]
2-[4-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]ethyl decanoate [ACD/IUPAC Name]
8-Chloro-10-(4-(2-decanoyloxyethyl)piperazino)-10,11-dihydrodibenzo(b,f)thiepin
Décanoate de 2-[4-(8-chloro-10,11-dihydrodibenzo[b,f]thiépin-10-yl)-1-pipérazinyl]éthyle [French] [ACD/IUPAC Name]
Decanoic acid, 2-(4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)ethyl ester
Decanoic acid, 2-[4-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]ethyl ester [ACD/Index Name]
2-(4-(8-Chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)piperazin-1-yl)ethyl decanoate
41931-83-3 [RN]
Noroxyclothepin decanoate

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

Vufb-9976 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 604.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.4±31.5 °C
Index of Refraction: 1.572
Molar Refractivity: 152.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 8.61
ACD/LogD (pH 5.5): 7.14
ACD/BCF (pH 5.5): 84243.73
ACD/KOC (pH 5.5): 56141.96
ACD/LogD (pH 7.4): 8.19
ACD/BCF (pH 7.4): 959500.44
ACD/KOC (pH 7.4): 639433.19
Polar Surface Area: 58 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 463.6±3.0 cm3

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