ChemSpider 2D Image | metofenazate | C31H36ClN3O5S

metofenazate

  • Molecular FormulaC31H36ClN3O5S
  • Average mass598.153 Da
  • Monoisotopic mass597.206421 Da
  • ChemSpider ID9417

More details:

Featured data source
The Merck Index Online

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

2-[4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazinyl]ethyl 3,4,5-trimethoxybenzoate
2-[4-[3-(2-Chlorophenothiazin-10-yl)propyl]-1-piperazinyl]ethyl-3,4,5-Trimethoxybenzoate
2-{4-[3-(2-Chlor-10H-phenothiazin-10-yl)propyl]-1-piperazinyl}ethyl-3,4,5-trimethoxybenzoat [German] [ACD/IUPAC Name]
2-{4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazinyl}ethyl 3,4,5-trimethoxybenzoate [ACD/IUPAC Name]
2-{4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]piperazin-1-yl}ethyl 3,4,5-trimethoxybenzoate
27J5OW8OGT
3,4,5-Triméthoxybenzoate de 2-{4-[3-(2-chloro-10H-phénothiazin-10-yl)propyl]-1-pipérazinyl}éthyle [French] [ACD/IUPAC Name]
3,4,5-Trimethoxybenzoic Acid 2-[4-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-1-piperazinyl]ethyl Ester
388-51-2 [RN]
522-23-6 [RN]
More...

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

2110 [DBID]
773134 [DBID]
BRN 0773134 [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: 694.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 374.0±31.5 °C
Index of Refraction: 1.601
Molar Refractivity: 164.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.43
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 505.38
ACD/KOC (pH 5.5): 915.30
ACD/LogD (pH 7.4): 5.98
ACD/BCF (pH 7.4): 17789.47
ACD/KOC (pH 7.4): 32218.43
Polar Surface Area: 89 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 479.1±3.0 cm3

Click to predict properties on the Chemicalize site


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