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CAS No.: | 207601-31-8 |
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Name: | 2,3-DIMETHOXYINDOLE |
Molecular Structure: | |
Formula: | C10H11NO2 |
Molecular Weight: | 177.2 |
Synonyms: | 2,3-Dimethoxyindole; |
Density: | 1.182 g/cm3 |
Boiling Point: | 320.3 °C at 760 mmHg |
Flash Point: | 117.4 °C |
PSA: | 34.25000 |
LogP: | 2.18510 |
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The CAS register number of 1H-Indole,2,3-dimethoxy- is 207601-31-8. It also can be called as 2,3-Dimethoxyindole and the systematic name about this chemical is 2,3-dimethoxy-1H-indole. The molecular formula about this chemical is C10H11NO2 and the molecular weight is 177.2.
Physical properties about 1H-Indole,2,3-dimethoxy- are: (1)ACD/LogP: 1.88; (2)ACD/LogD (pH 5.5): 1.88; (3)ACD/LogD (pH 7.4): 1.88 ; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 2; (7)Polar Surface Area: 34.25 Å2; (8)Index of Refraction: 1.608; (9)Molar Refractivity: 51.88 cm3; (10)Molar Volume: 149.8 cm3; (11)Polarizability: 20.56x10-24cm3; (12)Surface Tension: 43.1 dyne/cm; (13)Density: 1.182 g/cm3; (14)Flash Point: 117.4 °C; (15)Enthalpy of Vaporization: 53.96 kJ/mol; (16)Boiling Point: 320.3 °C at 760 mmHg; (17)Vapour Pressure: 0.0006 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: COc1c2ccccc2[nH]c1OC
(2)InChI: InChI=1/C10H11NO2/c1-12-9-7-5-3-4-6-8(7)11-10(9)13-2/h3-6,11H,1-2H3
(3)InChIKey: NKROKGXCQINQQK-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H11NO2/c1-12-9-7-5-3-4-6-8(7)11-10(9)13-2/h3-6,11H,1-2H3
(5)Std. InChIKey: NKROKGXCQINQQK-UHFFFAOYSA-N