CAS No.383861-22-1,4-(5'-INDOLE)PIPERIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	383861-22-1
Name:	4-(5'-INDOLE)PIPERIDINE
Article Data:	3

Formula:	C₁₃H₁₆N₂
Molecular Weight:	200.283
Synonyms:	5-(Piperidin-4-yl)-1H-indole;5-(4-Piperidinyl)-1H-indole;
Density:	1.118 g/cm³
Boiling Point:	388.6 °C at 760 mmHg
Flash Point:	188.8 °C
PSA:	27.82000
LogP:	2.96370

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Specification

The 1H-Indole,5-(4-piperidinyl)-, with CAS registry number 383861-22-1, has the systematic name of 5-(4-piperidyl)-1H-indole. Besides this, it is also called 4-(5'-Indole)piperidine. And the chemical formula of this chemical is C₁₃H₁₆N₂. Its molecular weight is 200.2795.

Physical properties of 1H-Indole,5-(4-piperidinyl)-: (1)ACD/LogP: 2.31; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 27.82 Å²; (7)Index of Refraction: 1.622; (8)Molar Refractivity: 63.12 cm³; (9)Molar Volume: 179.1 cm³; (10)Polarizability: 25.02×10^-24cm³; (11)Surface Tension: 47.3 dyne/cm; (12)Density: 1.118 g/cm³; (13)Flash Point: 188.8 °C; (14)Enthalpy of Vaporization: 63.78 kJ/mol; (15)Boiling Point: 388.6 °C at 760 mmHg; (16)Vapour Pressure: 3.03E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(cc2ccnc12)C3CCNCC3
(2)InChI: InChI=1/C13H16N2/c1-2-13-12(5-8-15-13)9-11(1)10-3-6-14-7-4-10/h1-2,5,8-10,14-15H,3-4,6-7H2
(3)InChIKey: ULMINHJMQWBDGD-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C13H16N2/c1-2-13-12(5-8-15-13)9-11(1)10-3-6-14-7-4-10/h1-2,5,8-10,14-15H,3-4,6-7H2
(5)Std. InChIKey: ULMINHJMQWBDGD-UHFFFAOYSA-N