Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
6-Bromo-1H-pyrrolo[3,2-b]pyridine |
EINECS | N/A |
CAS No. | 944937-53-5 | Density | 1.77 g/cm3 |
PSA | 28.68000 | LogP | 2.32540 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H5BrN2 | Boiling Point | 311.3 °C at 760 mmHg |
Molecular Weight | 197.034 | Flash Point | 142.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26 | Risk Codes | 22-36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
6-Bromo-1H-pyrrolo[3,2-b]pyridine; |
Article Data | 2 |
The 6-Bromo-1H-pyrrolo[3,2-b]pyridine is an organic compound with the formula C7H5BrN2. The IUPAC name of this chemical is 6-bromo-1H-pyrrolo[3,2-b]pyridine. With the CAS registry number 944937-53-5, it is also named as 6-bromopyrrolo[3,2-b]pyridine.
Physical properties about 6-Bromo-1H-pyrrolo[3,2-b]pyridine are: (1)ACD/LogP: 1.72; (2)ACD/LogD (pH 5.5): 1.66; (3)ACD/LogD (pH 7.4): 1.72; (4)#H bond acceptors: 2; (5)#H bond donors: 1; (6)Polar Surface Area: 28.68 Å2; (7)Index of Refraction: 1.727; (8)Molar Refractivity: 44.3 cm3; (9)Molar Volume: 111.2 cm3; (10)Polarizability: 17.56×10-24cm3; (11)Surface Tension: 64.4 dyne/cm; (12)Density: 1.77 g/cm3; (13)Flash Point: 142.1 °C; (14)Enthalpy of Vaporization: 53.02 kJ/mol; (15)Boiling Point: 311.3 °C at 760 mmHg; (16)Vapour Pressure: 0.00104 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc2nccc2nc1
(2)InChI: InChI=1/C7H5BrN2/c8-5-3-7-6(10-4-5)1-2-9-7/h1-4,9H
(3)InChIKey: OJFFFCVPCVATIV-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C7H5BrN2/c8-5-3-7-6(10-4-5)1-2-9-7/h1-4,9H
(5)Std. InChIKey: OJFFFCVPCVATIV-UHFFFAOYSA-N