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7-Methoxy-2-methyl-1H-indole-3-carbaldehyde

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Name

7-Methoxy-2-methyl-1H-indole-3-carbaldehyde

EINECS N/A
CAS No. 933711-43-4 Density 1.23 g/cm3
PSA 42.09000 LogP 2.29740
Solubility N/A Melting Point N/A
Formula C11H11NO2 Boiling Point 381.2 °C at 760 mmHg
Molecular Weight 189.21 Flash Point 184.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 933711-43-4 (7-methoxy-2-methyl-1H-indole-3-carbaldehyde) Hazard Symbols N/A
Synonyms

7-Methoxy-2-methyl-1H-indole-3-carbaldehyde;

 

7-Methoxy-2-methyl-1H-indole-3-carbaldehyde Specification

The CAS register number of 7-Methoxy-2-methyl-1H-indole-3-carbaldehyde is 933711-43-4. The systematic name about this chemical is 1H-indole-3-carboxaldehyde, 7-methoxy-2-methyl-. The molecular formula about this chemical is C11H11NO2 and molecular weight is 189.21.

Physical properties about 7-Methoxy-2-methyl-1H-indole-3-carbaldehyde are: (1)ACD/LogP: 2.06; (2)ACD/LogD (pH 5.5): 2.06; (3)ACD/LogD (pH 7.4): 2.06; (4)ACD/BCF (pH 5.5): 21.64; (5)ACD/BCF (pH 7.4): 21.64; (6)ACD/KOC (pH 5.5): 314.34; (7)ACD/KOC (pH 7.4): 314.34; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 42.09Å2; (12)Index of Refraction: 1.66; (13)Molar Refractivity: 56.78 cm3; (14)Molar Volume: 153.8 cm3; (15)Polarizability: 22.51x10-24cm3; (16)Surface Tension: 50.5 dyne/cm; (17)Enthalpy of Vaporization: 62.95 kJ/mol; (18)Boiling Point: 381.2 °C at 760 mmHg; (19)Vapour Pressure: 5.14E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(c2cccc(c2[nH]1)OC)C=O
(2)InChI: InChI=1/C11H11NO2/c1-7-9(6-13)8-4-3-5-10(14-2)11(8)12-7/h3-6,12H,1-2H3
(3)InChIKey: RKIMRJGRXUMIMB-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C11H11NO2/c1-7-9(6-13)8-4-3-5-10(14-2)11(8)12-7/h3-6,12H,1-2H3
(5)Std. InChIKey: RKIMRJGRXUMIMB-UHFFFAOYSA-N

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