6-Fluoro-7-methylindole supplier

Name
6-Fluoro-7-methylindole
EINECS
CAS No. 57817-10-4
Density 1.219 g/cm³
Solubility
Melting Point 77-82°C
Formula C₉H₈FN
Boiling Point 264.98 °C at 760 mmHg
Molecular Weight 149.168
Flash Point 114.056 °C
Transport Information
Appearance
Safety 26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 6-Fluoro-7-methyl-1H-indole;6-Fluoro-7-methylindole;
PSA 15.79000
LogP 2.61540

6-Fluoro-7-methylindole Specification

The systematic name of 6-Fluoro-7-methylindole is 6-fluoro-7-methyl-1H-indole. With the CAS registry number 57817-10-4, it is also named as 1H-Indole,6-fluoro-7-methyl-. The product's category is Halide. In addition, its molecular formula is C₉H₈FN and molecular weight is 149.16.

The other characteristics of 6-Fluoro-7-methylindole can be summarized as: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 61; (6)ACD/BCF (pH 7.4): 61; (7)ACD/KOC (pH 5.5): 662; (8)ACD/KOC (pH 7.4): 662; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 15.79 Å²; (13)Index of Refraction: 1.627; (14)Molar Refractivity: 43.347 cm³; (15)Molar Volume: 122.357 cm³; (16)Polarizability: 17.184×10^-24cm³; (17)Surface Tension: 44.196 dyne/cm; (18)Density: 1.219 g/cm³; (19)Flash Point: 114.056 °C; (20)Enthalpy of Vaporization: 48.261 kJ/mol; (21)Boiling Point: 264.98 °C at 760 mmHg; (22)Vapour Pressure: 0.015 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: Fc1ccc2ccnc2c1C
(2)InChI: InChI=1/C9H8FN/c1-6-8(10)3-2-7-4-5-11-9(6)7/h2-5,11H,1H3
(3)InChIKey: NWXBSWUAWHBOSL-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C9H8FN/c1-6-8(10)3-2-7-4-5-11-9(6)7/h2-5,11H,1H3
(5)Std. InChIKey: NWXBSWUAWHBOSL-UHFFFAOYSA-N

Product Name

6-Fluoro-7-methylindole

6-Fluoro-7-methylindole Specification

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