1H-Indole,7-bromo-4-fluoro- supplier

Name
7-BROMO-4-FLUOROINDOLE
EINECS
CAS No. 292636-09-0
Article Data9
CAS DataBase
Density 1.75 g/cm³
Solubility
Melting Point
Formula C₈H₅BrFN
Boiling Point 314.2 °C at 760 mmHg
Molecular Weight 214.037
Flash Point 143.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Fluoro-7-bromoindole;7-Bromo-4-fluoroindole;7-Bromo-4-fluoro-1H-indole;1H-indole, 7-bromo-4-fluoro-;
PSA 15.79000
LogP 3.06950

1H-Indole,7-bromo-4-fluoro- Specification

The 1H-Indole,7-bromo-4-fluoro-, with the CAS registry number 292636-09-0, has the systematic name of 7-bromo-4-fluoro-1H-indole. It is a kind of light sensitive chemical, and the molecular formula of the chemical is C₈H₅BrFN.

The characteristics of 1H-Indole,7-bromo-4-fluoro- are as followings: (1)ACD/LogP: 2.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.9; (4)ACD/LogD (pH 7.4): 2.9; (5)ACD/BCF (pH 5.5): 94.27; (6)ACD/BCF (pH 7.4): 94.27; (7)ACD/KOC (pH 5.5): 901.28; (8)ACD/KOC (pH 7.4): 901.28; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 4.93 Å²; (13)Index of Refraction: 1.68; (14)Molar Refractivity: 46.21 cm³; (15)Molar Volume: 122.2 cm³; (16)Polarizability: 18.32×10^-24cm³; (17)Surface Tension: 52 dyne/cm; (18)Density: 1.75 g/cm³; (19)Flash Point: 143.8 °C; (20)Enthalpy of Vaporization: 53.32 kJ/mol; (21)Boiling Point: 314.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000874 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1ccc(Br)c2c1ccn2
(2)InChI: InChI=1/C8H5BrFN/c9-6-1-2-7(10)5-3-4-11-8(5)6/h1-4,11H
(3)InChIKey: PRXUTIXCOBFMMM-UHFFFAOYAI

Product Name

7-BROMO-4-FLUOROINDOLE

1H-Indole,7-bromo-4-fluoro- Specification

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