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CAS No.: | 10075-48-6 |
---|---|
Name: | 5-BROMO-3-METHYLINDOLE |
Article Data: | 31 |
Molecular Structure: | |
Formula: | C9H8BrN |
Molecular Weight: | 210.073 |
Synonyms: | Indole,5-bromo-3-methyl- (8CI);3-Methyl-5-bromoindole;5-Bromo-3-methyl-1H-indole;5-Bromo-3-methylindole;5-Bromoskatole;NSC 79234; |
Density: | 1.563 g/cm3 |
Melting Point: | 78-82°C |
Boiling Point: | 325.1 °C at 760 mmHg |
Flash Point: | 150.4 °C |
Hazard Symbols: | Xi |
Risk Codes: | Xi:Irritant; "> Xi:Irritant; |
Safety: | 26-39 |
PSA: | 15.79000 |
LogP: | 3.23880 |
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The 1H-Indole,5-bromo-3-methyl-, with the CAS registry number 10075-48-6, is also known as NSC79234. It belongs to the product categories of Halogenated; Indole; Organohalides. This chemical's molecular formula is C9H8BrN and molecular weight is 210.07052. Its IUPAC name is called 5-bromo-3-methyl-1H-indole. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of 1H-Indole,5-bromo-3-methyl-: (1)ACD/LogP: 3.46; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)Index of Refraction: 1.684; (5)Molar Refractivity: 51.04 cm3; (6)Molar Volume: 134.3 cm3; (7)Surface Tension: 50.9 dyne/cm; (8)Density: 1.563 g/cm3; (9)Flash Point: 150.4 °C; (10)Enthalpy of Vaporization: 54.46 kJ/mol; (11)Boiling Point: 325.1 °C at 760 mmHg; (12)Vapour Pressure: 0.000446 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CNC2=C1C=C(C=C2)Br
(2)InChI: InChI=1S/C9H8BrN/c1-6-5-11-9-3-2-7(10)4-8(6)9/h2-5,11H,1H3
(3)InChIKey: GDQXDVJFMLNXHX-UHFFFAOYSA-N