Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Bromopyrrole |
EINECS | N/A |
CAS No. | 87630-40-8 | Density | 1.739 g/cm3 |
PSA | 15.79000 | LogP | 1.77720 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H4BrN | Boiling Point | 210.837 °C at 760 mmHg |
Molecular Weight | 145.986 | Flash Point | 81.312 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Bromopyrrole; |
Article Data | 10 |
The 3-Bromopyrrole with its cas register number is 87630-40-8. It also can be called as 3-Bromo-1H-pyrrole and the Systematic name about this chemical is 3-bromo-1H-pyrrole. It belongs to the following product categories, such as Halide and Benzenes.
Physical properties about 3-Bromopyrrole are: (1)ACD/LogP: 1.60; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 8; (5)ACD/BCF (pH 7.4): 8; (6)ACD/KOC (pH 5.5): 160; (7)ACD/KOC (pH 7.4): 160; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)Polar Surface Area: 15.79Å2; (11)Index of Refraction: 1.591; (12)Molar Refractivity: 28.376 cm3; (13)Molar Volume: 83.941 cm3; (14)Polarizability: 11.249x10-24cm3; (15)Surface Tension: 44.973 dyne/cm; (16)Enthalpy of Vaporization: 42.889 kJ/mol; (17)Vapour Pressure: 0.273 mmHg at 25°C
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccnc1
(2)InChI: InChI=1/C4H4BrN/c5-4-1-2-6-3-4/h1-3,6H
(3)InChIKey: ZZHFDFIWLDELCX-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C4H4BrN/c5-4-1-2-6-3-4/h1-3,6H
(5)Std. InChIKey: ZZHFDFIWLDELCX-UHFFFAOYSA-N