1H-Indole,5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- supplier

Name
5-BROMO-3-[2-(1-PYRROLIDINYL)ETHYL]-1H-INDOLE
EINECS
CAS No. 17274-68-9
Article Data2
CAS DataBase
Density 1.418 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₇BrN₂
Boiling Point 419.5 °C at 760 mmHg
Molecular Weight 293.206
Flash Point 207.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Indole, 5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- (8CI);5-Bromo-3-[2-(pyrrolidin-1-yl)ethyl]-1H-indole;5-Bromo-3-[2-(1-pyrrolidinyl)ethyl]-1H-indole;
PSA 19.03000
LogP 3.50660

1H-Indole,5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- Specification

The 1H-Indole,5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- is an organic compound with the formula C₁₄H₁₇BrN₂. The systematic name of this chemical is 5-Bromo-3-[2-(pyrrolidin-1-yl)ethyl]-1H-indole. With the CAS registry number 17274-68-9, it is also named as 5-Bromo-3-[2-(1-pyrrolidinyl)ethyl]-1H-indole. Besides, its molecular weight is 293.2.

Physical properties about 1H-Indole,5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- are: (1)ACD/LogP: 3.49; (2)ACD/LogD (pH 5.5): 0.4; (3)ACD/LogD (pH 7.4): 0.8; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.53; (7)ACD/KOC (pH 7.4): 3.87; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 19.03 Å²; (12)Index of Refraction: 1.654; (13)Molar Refractivity: 75.79 cm³; (14)Molar Volume: 206.6 cm³; (15)Polarizability: 30.04×10^-24 cm³; (16)Surface Tension: 53.2 dyne/cm; (17)Density: 1.418 g/cm³; (18)Flash Point: 207.5 °C; (19)Enthalpy of Vaporization: 67.32 kJ/mol; (20)Boiling Point: 419.5 °C at 760 mmHg; (21)Vapour Pressure: 3.03E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C14H17BrN2/c15-12-3-4-14-13(9-12)11(10-16-14)5-8-17-6-1-2-7-17/h3-4,9-10,16H,1-2,5-8H2
(2)InChIKey: OTKDIZOYQXFTDK-UHFFFAOYAK
(3)Std. InChI: InChI=1S/C14H17BrN2/c15-12-3-4-14-13(9-12)11(10-16-14)5-8-17-6-1-2-7-17/h3-4,9-10,16H,1-2,5-8H2
(4)Std. InChIKey: OTKDIZOYQXFTDK-UHFFFAOYSA-N

Product Name

5-BROMO-3-[2-(1-PYRROLIDINYL)ETHYL]-1H-INDOLE

1H-Indole,5-bromo-3-[2-(1-pyrrolidinyl)ethyl]- Specification

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