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| CAS No.: | 2426-63-3 |
|---|---|
| Name: | 5-METHOXY-3-(2-DIISOPROPYLAMINOETHYL)INDOLE HYDROCHLORIDE |
| Molecular Structure: | |
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| Formula: | C17H27ClN2O |
| Molecular Weight: | 310.86 |
| Synonyms: | 5-Methoxy-N,N-diisopropyltryptamine hydrochloride;1H-Indole-3-ethanamine,5-methoxy-N,N-bis(1-methylethyl)-, monohydrochloride (9CI);Indole,3-[2-(diisopropylamino)ethyl]-5-methoxy-, hydrochloride (7CI,8CI); |
| Melting Point: | 182-184℃ |
| Boiling Point: | 439.3 °C at 760 mmHg |
| Flash Point: | 219.5 °C |
| PSA: | 28.26000 |
| LogP: | 4.63980 |
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Specification
The 1H-Indole-3-ethanamine,5-methoxy-N,N-bis(1-methylethyl)-, hydrochloride (1:1), with the CAS registry number 2426-63-3, is also known as 5-Methoxy-3-N,N-diisopropylaminoethylindole. It belongs to the product category of Indoles and Derivatives. This chemical's molecular formula is C17H27ClN2O and molecular weight is 310.86. Its systematic name is called N-isopropyl-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]propan-2-amine hydrochloride.
Physical properties of 1H-Indole-3-ethanamine,5-methoxy-N,N-bis(1-methylethyl)-, hydrochloride (1:1): (1)ACD/LogP: 3.73; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 6; (5)Flash Point: 219.5 °C; (6)Enthalpy of Vaporization: 70.96 kJ/mol; (7)Boiling Point: 439.3 °C at 760 mmHg; (8)Vapour Pressure: 4.03E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.CC(C)N(CCc2cnc1ccc(cc12)OC)C(C)C
(2)InChI: InChI=1/C17H26N2O.ClH/c1-12(2)19(13(3)4)9-8-14-11-18-17-7-6-15(20-5)10-16(14)17;/h6-7,10-13,18H,8-9H2,1-5H3;1H
(3)InChIKey: QEBJXWFHKCUFLS-UHFFFAOYAY