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154989-45-4

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Basic Information
CAS No.: 154989-45-4
Name: 7-ETHYL-1H-INDOLE-3-CARBALDEHYDE
Article Data: 3
Molecular Structure:
Molecular Structure of 154989-45-4 (7-ETHYL-1H-INDOLE-3-CARBALDEHYDE)
Formula: C11H11NO
Molecular Weight: 173.214
Synonyms: ASISCHEM W79746;7-ETHYL-1H-INDOLE-3-CARBALDEHYDE;7-ETHYL-3-FORMYLINDOLE;7-ETHYLINDOLE-3-ALDEHYDE;7-ETHYLINDOLE-3-CARBOXALDEHYDE;5-Ethylindole-3-Carboxaldehyde;1H-Indole-3-carboxaldehyde, 7-ethyl-
Density: 1.183 g/cm3
Boiling Point: 356.1 °C at 760 mmHg
Flash Point: 176.9 °C
Hazard Symbols: IrritantXi
Risk Codes:  Xi:;
">  Xi:;
Safety: 26
PSA: 32.86000
LogP: 2.54280
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Specification

The 1H-Indole-3-carboxaldehyde,7-ethyl- is an organic compound with the formula C11H11NO. The IUPAC name of this chemical is 7-Ethyl-1H-indole-3-carbaldehyde. With the CAS registry number 154989-45-4, it is also named as 7-Ethylindole-3-carboxaldehyde. Besides, its molecular weight is 173.21.

Physical properties about 1H-Indole-3-carboxaldehyde,7-ethyl- are: (1)ACD/LogP: 2.68; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 22 Å2; (6)Index of Refraction: 1.672; (7)Molar Refractivity: 54.83 cm3; (8)Molar Volume: 146.3 cm3; (9)Polarizability: 21.73×10-24 cm3; (10)Surface Tension: 51.6 dyne/cm; (11)Density: 1.183 g/cm3; (12)Flash Point: 176.9 °C; (13)Enthalpy of Vaporization: 60.13 kJ/mol; (14)Boiling Point: 356.1 °C at 760 mmHg; (15)Vapour Pressure: 2.99E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H11NO/c1-2-8-4-3-5-10-9(7-13)6-12-11(8)10/h3-7,12H,2H2,1H3
(2)InChIKey: DKTNMUOPASFCOT-UHFFFAOYAD
(3)Std. InChI: InChI=1S/C11H11NO/c1-2-8-4-3-5-10-9(7-13)6-12-11(8)10/h3-7,12H,2H2,1H3
(4)Std. InChIKey: DKTNMUOPASFCOT-UHFFFAOYSA-N