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Cas Database |
| Name |
Eltoprazine |
EINECS | N/A |
| CAS No. | 98224-03-4 | Density | 1.18g/cm3 |
| PSA | 33.73000 | LogP | 1.26120 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C12H16N2O2 | Boiling Point | 384.3°Cat760mmHg |
| Molecular Weight | 220.271 | Flash Point | 186.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1,4-Benzodioxin,piperazine deriv.;1-(2,3-Dihydro-1,4-benzodioxan-5-yl)piperazine;1-(2,3-Dihydro-1,4-benzodioxin-5-yl)piperazine;4-(2,3-Dihydro-1,4-benzodioxin-5-yl)-1-piperazine;4-(2,3-Dihydrobenzo[1,4]dioxin-5-yl)piperazine;N-(2,3-Dihydrobenzo[1,4]dioxin-5-yl)piperazine;Piperazine,1-(2,3-dihydro-1,4-benzodioxin-5-yl)-; |
Article Data | 11 |
Eltoprazine Synthetic route
- 110-85-0
piperazine
- 5-bromo-2,3-dihydrobenzo[1,4]dioxin
- 58328-39-5
5-bromo-2,3-dihydrobenzo[1,4]dioxin
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| With tris-(dibenzylideneacetone)dipalladium(0); 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; sodium t-butanolate In toluene at 100℃; for 4h; Sealed tube; | 59% |
- 821-48-7
bis-(2-chloroethyl)amine hydrochloride
- 16081-45-1
1,4-benzodioxan-5-amine
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| In chlorobenzene Reflux; | 51% |
| With potassium carbonate In chlorobenzene for 24h; Heating; | |
| With sodium hydroxide In chlorobenzene | |
| In sodium hydroxide; chlorobenzene | |
| In sodium hydroxide; chlorobenzene |
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| With trifluoroacetic acid In dichloromethane Ambient temperature; Yield given; |
- 58328-39-5
5-bromo-2,3-dihydrobenzo[1,4]dioxin
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: tri(o-tolyl)phosphine, bis(dibenzylideneacetone)palladium(O), sodium tert-butoxide / toluene / 100 °C 2: trifluoroacetic acid / CH2Cl2 / Ambient temperature View Scheme |
- 4442-53-9
2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 4 steps 1.1: triethylamine / water; acetone / 0 °C 2.1: sodium azide / water; acetone 2.2: Heating 3.1: hydrogenchloride / water / Reflux 4.1: chlorobenzene / Reflux View Scheme |
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1.1: sodium azide / water; acetone 1.2: Heating 2.1: hydrogenchloride / water / Reflux 3.1: chlorobenzene / Reflux View Scheme |
- 1155139-88-0
C9H7NO3
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: hydrogenchloride / water / Reflux 2: chlorobenzene / Reflux View Scheme |
- 1775-27-5
2-bromoindanone
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| With potassium carbonate In N,N-dimethyl-formamide at 20℃; for 48h; | 100% |
- 3389-21-7
3-(2-bromoethyl)-1H-indole
- 98224-03-4
eltoprazine
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine; potassium iodide In acetonitrile Heating; | 99% |
- 50-00-0
formaldehyd
- 98224-03-4
eltoprazine
- 4705-52-6
6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3(2H,5H)-dione
| Conditions | Yield |
|---|---|
| In methanol; water Mannich reaction; Heating; | 88% |
Eltoprazine Chemical Properties
IUPAC Name: 1-(2,3-Dihydro-1,4-benzodioxin-8-yl)piperazine
Synonyms of Eltoprazine (CAS NO.98224-03-4): Eltoprazina ; Eltoprazinum ; 1-(1,4-Benzodioxan-5-yl)piperazine
CAS NO: 98224-03-4
Molecular Formula: C12H16N2O2
Molecular Weight: 220.2676
Molecular Structure: .png)
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 24.94 Å2
Index of Refraction: 1.562
Molar Refractivity: 60.57 cm3
Molar Volume: 186.6 cm3
Surface Tension: 42.5 dyne/cm
Density: 1.18 g/cm3
Flash Point: 186.2 °C
Enthalpy of Vaporization: 63.29 kJ/mol
Boiling Point: 384.3 °C at 760 mmHg
Vapour Pressure: 4.13E-06 mmHg at 25°C
Product Categories of Eltoprazine (CAS NO.98224-03-4): Pyrans, Piperidines &Piperazines;Pyrans, Piperidines & Piperazines
SMILES: O1c2c(OCC1)c(ccc2)N3CCNCC3
InChI: InChI=1/C12H16N2O2/c1-2-10(14-6-4-13-5-7-14)12-11(3-1)15-8-9-16-12/h1-3,13H,4-9H2
InChIKey: WVLHGCRWEHCIOT-UHFFFAOYAT
Std. InChI: InChI=1S/C12H16N2O2/c1-2-10(14-6-4-13-5-7-14)12-11(3-1)15-8-9-16-12/h1-3,13H,4-9H2
Std. InChIKey: WVLHGCRWEHCIOT-UHFFFAOYSA-N
Eltoprazine Uses
Eltoprazine (CAS NO.98224-03-4) is a drug of the phenylpiperazine class which is a serenic or antiaggressive agent. It acts as an agonist at the 5-HT1A and 5-HT1B receptors and as an antagonist at the 5-HT2C receptor.
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