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CAS No.: | 10604-59-8 |
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Name: | 1-Ethyl-1H-indole |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C10H11N |
Molecular Weight: | 145.204 |
Synonyms: | Indole,1-ethyl- (6CI,7CI,8CI);1-Ethyl-1H-indole;1-Ethylindole;N-Ethylindole;NSC93082; |
Density: | 0.99 g/cm3 |
Melting Point: | 105°C |
Boiling Point: | 253.5 °C at 760 mmHg |
Flash Point: | 107.1 °C |
PSA: | 4.93000 |
LogP: | 2.66120 |
The 1H-Indole, 1-ethyl-, with the CAS registry number 10604-59-8, is also known as N-Ethylindole. This chemical's molecular formula is C10H11N and molecular weight is 145.20. What's more, its IUPAC name is 1-Ethylindole.
Physical properties of 1H-Indole, 1-ethyl- are: (1)ACD/LogP: 3.07; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 4.93 Å2; (7)Index of Refraction: 1.56; (8)Molar Refractivity: 47.3 cm3; (9)Molar Volume: 146.2 cm3; (10)Polarizability: 18.75×10-24 cm3; (11)Surface Tension: 35.6 dyne/cm; (12)Density: 0.99 g/cm3; (13)Flash Point: 107.1 °C; (14)Enthalpy of Vaporization: 47.11 kJ/mol; (15)Boiling Point: 253.5 °C at 760 mmHg; (16)Vapour Pressure: 0.029 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCN1C=CC2=CC=CC=C21
(2)InChI: InChI=1S/C10H11N/c1-2-11-8-7-9-5-3-4-6-10(9)11/h3-8H,2H2,1H3
(3)InChIKey: QRRKZFCXXBFHSV-UHFFFAOYSA-N