CAS No.14780-24-6,N,N-diisopropyltryptamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	14780-24-6
Name:	N,N-diisopropyltryptamine

Formula:	C₁₆H₂₄N₂
Molecular Weight:	244.38
Synonyms:	N,N-Bis(1-methylethyl)-1H-indole-3-ethanamine;N-[2-(1H-Indol-3-yl)ethyl]-N-isopropylpropan-2-amine;3-[2-(Diisopropylamino)ethyl]indole;
Density:	1.011 g/cm³
Boiling Point:	376.401 °C at 760 mmHg
Flash Point:	181.441 °C
PSA:	19.03000
LogP:	3.82920

Synthetic route

indol-3-yl-glyoxylic acid diisopropylamide: indol-3-yl-glyoxylic acid diisopropylamide

: 14780-24-6
N,N-Diisopropyltryptamine

Conditions

Conditions	Yield
With tetrahydrofuran; lithium aluminium tetrahydride

: 14780-24-6
N,N-Diisopropyltryptamine

: 1294480-58-2
3-[2-(N,N-diisopropylamino)ethyl]-3-fluoro-2-oxoindole

Conditions

Conditions	Yield
With aluminum (III) chloride; Selectfluor In methanol; acetonitrile at 0 - 20℃; for 0.5h;	98%

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Specification

The N,N-Diisopropyltryptamine, with the CAS registry number 14780-24-6, is also known as N,N-Bis(1-methylethyl)-1H-indole-3-ethanamine. This chemical's molecular formula is C₁₆H₂₄N₂ and molecular weight is 244.38. What's more, its systematic name is N-[2-(1H-Indol-3-yl)ethyl]-N-isopropyl-2-propanamine. This chemical is a psychedelic hallucinogenic drug of the tryptamine family that has a unique effect. While the majority of hallucinogens affect the visual sense, it is primarily aural. It has been suggested that it may have value to researchers of neurology due to its complex audio distorting effects.

Physical properties of N,N-Diisopropyltryptamine are: (1)ACD/LogP: 4.299; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.20; (4)ACD/LogD (pH 7.4): 1.34; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.21; (7)ACD/KOC (pH 5.5): 4.15; (8)ACD/KOC (pH 7.4): 5.76; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 19.03 Å²; (13)Index of Refraction: 1.572; (14)Molar Refractivity: 79.514 cm³; (15)Molar Volume: 241.736 cm³; (16)Polarizability: 31.522×10^-24cm³; (17)Surface Tension: 39.6 dyne/cm; (18)Density: 1.011 g/cm³; (19)Flash Point: 181.441 °C; (20)Enthalpy of Vaporization: 62.404 kJ/mol; (21)Boiling Point: 376.401 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cccc2c1c(cn2)CCN(C(C)C)C(C)C
(2)Std. InChI: InChI=1S/C16H24N2/c1-12(2)18(13(3)4)10-9-14-11-17-16-8-6-5-7-15(14)16/h5-8,11-13,17H,9-10H2,1-4H3
(3)Std. InChIKey: ZRVAAGAZUWXRIP-UHFFFAOYSA-N