1H-Indole-3-ethanamine,5-nitro- supplier

Name
3-(2-AMINOETHYL)-5-NITROINDOLE
EINECS
CAS No. 55747-72-3
Article Data7
CAS DataBase
Density 1.366 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁N₃O₂
Boiling Point 434.3 °C at 760 mmHg
Molecular Weight 205.216
Flash Point 216.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Nitro-1H-indole-3-ethanamine;3-(2-Aminoethyl)-5-nitroindole;2-(5-Nitro-1H-indol-3-yl)ethan-1-amine;
PSA 87.63000
LogP 2.80080

1H-Indole-3-ethanamine,5-nitro- Specification

The 1H-Indole-3-ethanamine,5-nitro-, with the CAS registry number 55747-72-3, is also known as 5-Nitro-1H-indole-3-ethanamine. It belongs to the product category of Indoles and Derivatives. This chemical's molecular formula is C₁₀H₁₁N₃O₂ and molecular weight is 205.21. What's more, its IUPAC name is 2-(5-nitro-1H-indol-3-yl)ethanamine.

Physical properties of 1H-Indole-3-ethanamine,5-nitro- are: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 53.99 Å²; (7)Index of Refraction: 1.701; (8)Molar Refractivity: 58.15 cm³; (9)Molar Volume: 150.2 cm³; (10)Polarizability: 23.05×10^-24cm³; (11)Surface Tension: 68.3 dyne/cm; (12)Density: 1.366 g/cm³; (13)Flash Point: 216.4 °C; (14)Enthalpy of Vaporization: 69.03 kJ/mol; (15)Boiling Point: 434.3 °C at 760 mmHg; (16)Vapour Pressure: 9.61E-08 mmHg at 25°C.

Uses of 1H-Indole-3-ethanamine,5-nitro-: it can be used to produce β-(5-nitro-3-indolyl)ethylaminopentachlorocyclotriphosphazene at the temperature of -10°C. It will need reagents hexachlorocyclotriphosphazene, triethylamine and solvent tetrahydrofuran with the reaction time of 45 min. The yield is about 40%.

1H-Indole-3-ethanamine,5-nitro-: it can be used to produce β-(5-nitro-3-indolyl)ethylaminopentachlorocyclotriphosphazene at the temperature of -10°C

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc2c(cc1)ncc2CCN
(2)Std. InChI: InChI=1S/C10H11N3O2/c11-4-3-7-6-12-10-2-1-8(13(14)15)5-9(7)10/h1-2,5-6,12H,3-4,11H2
(3)Std. InChIKey: GPZRBKWRRKBOAC-UHFFFAOYSA-N

Product Name

3-(2-AMINOETHYL)-5-NITROINDOLE

1H-Indole-3-ethanamine,5-nitro- Specification

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