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23084-35-7

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Basic Information
CAS No.: 23084-35-7
Name: 6-Methoxyindole-3-acetonitrile
Article Data: 15
Molecular Structure:
Molecular Structure of 23084-35-7 (6-Methoxyindole-3-acetonitrile)
Formula: C11H10N2O
Molecular Weight: 186.213
Synonyms: Indole-3-acetonitrile,6-methoxy- (6CI,8CI);6-Methoxy-1H-indole-3-acetonitrile;
Density: 1.224 g/cm3
Melting Point: 111-112 °C(Solv: benzene (71-43-2))
Boiling Point: 408.3 °C at 760 mmHg
Flash Point: 200.7 °C
PSA: 48.81000
LogP: 2.24258
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Specification

The 6-Methoxyindole-3-acetonitrile, with the CAS registry number 23084-35-7, is also known as 6-Methoxyindole-3-acetonitrile. It belongs to the product category of Indoles and derivatives. This chemical's molecular formula is C11H10N2O and molecular weight is 186.2099. Its systematic name is called (6-methoxy-1H-indol-3-yl)acetonitrile.

Physical properties of 6-Methoxyindole-3-acetonitrile: (1)ACD/LogP: 1.23; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Index of Refraction: 1.638; (6)Molar Refractivity: 54.66 cm3; (7)Molar Volume: 152 cm3; (8)Surface Tension: 54 dyne/cm; (9)Density: 1.224 g/cm3; (10)Flash Point: 200.7 °C; (11)Enthalpy of Vaporization: 66.03 kJ/mol; (12)Boiling Point: 408.3 °C at 760 mmHg; (13)Vapour Pressure: 7.09E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#CCc2c1ccc(OC)cc1nc2
(2)InChI: InChI=1/C11H10N2O/c1-14-9-2-3-10-8(4-5-12)7-13-11(10)6-9/h2-3,6-7,13H,4H2,1H3
(3)InChIKey: TXDMKKKJRXIVNO-UHFFFAOYAN