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Name |
3,5-Dibromoquinoline |
EINECS | N/A |
CAS No. | 101861-59-0 | Density | 1.924 g/cm3 |
PSA | 12.89000 | LogP | 3.75980 |
Solubility | N/A | Melting Point |
86℃ |
Formula | C9H5Br2N | Boiling Point | 333.054 °C at 760 mmHg |
Molecular Weight | 286.95 | Flash Point | 155.226 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3,5-dibromo-quinoline |
Article Data | 17 |
The 3,5-Dibromoquinoline, its CAS registry number is 101861-59-0. This chemical's molecular formula is C9H5Br2N and molecular weight is 286.95. It is an organic compound. And it should be stored in a cool, ventilated and dry place.
Physical properties of 3,5-Dibromoquinoline are: (1)ACD/LogP: 2.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.793; (4)ACD/LogD (pH 7.4): 2.793; (5)ACD/BCF (pH 5.5): 78.101; (6)ACD/BCF (pH 7.4): 78.108; (7)ACD/KOC (pH 5.5): 787.708; (8)ACD/KOC (pH 7.4): 787.774; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.699; (14)Molar Refractivity: 57.567 cm3; (15)Molar Volume: 149.143 cm3; (16)Polarizability: 22.821×10-24 cm3; (17)Surface Tension: 55.049 dyne/cm; (18)Density: 1.924 g/cm3; (19)Flash Point: 155.226 °C; (20)Enthalpy of Vaporization: 55.304 kJ/mol; (21)Boiling Point: 333.054 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(cc(cn2)Br)c(c1)Br
(2)InChI: InChI=1/C9H5Br2N/c10-6-4-7-8(11)2-1-3-9(7)12-5-6/h1-5H
(3)InChIKey: IBADFXOMCWHDMS-UHFFFAOYAB