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Name |
Quinoline,6-bromo-2-(1-piperazinyl)- |
EINECS | N/A |
CAS No. | 124782-95-2 | Density | 1.451 g/cm3 |
PSA | 28.16000 | LogP | 2.80070 |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H14BrN3 | Boiling Point | 451.8 °C at 760 mmHg |
Molecular Weight | 292.178 | Flash Point | 227 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
6-Bromo-2-(piperazin-1-yl)quinoline;6-Bromoquipazine; |
Article Data | 3 |
The CAS register number of Quinoline,6-bromo-2-(1-piperazinyl)- is 124782-95-2. It also can be called as 6-Bromoquipazine and the IUPAC name about this chemical is 6-bromo-2-piperazin-1-ylquinoline. The molecular formula about this chemical is C13H14BrN3 and the molecular weight is 292.17.
Physical properties about Quinoline,6-bromo-2-(1-piperazinyl)- are: (1)ACD/LogP: 2.34; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 19.37 Å2; (6)Index of Refraction: 1.65; (7)Molar Refractivity: 73.42 cm3; (8)Molar Volume: 201.2 cm3; (9)Polarizability: 29.1x10-24cm3; (10)Surface Tension: 52 dyne/cm; (11)Density: 1.451 g/cm3; (12)Flash Point: 227 °C; (13)Enthalpy of Vaporization: 71.09 kJ/mol; (14)Boiling Point: 451.8 °C at 760 mmHg; (15)Vapour Pressure: 2.37E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc3cc1c(nc(cc1)N2CCNCC2)cc3
(2)InChI: InChI=1/C13H14BrN3/c14-11-2-3-12-10(9-11)1-4-13(16-12)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2
(3)InChIKey: MKIHFWMBAKJYJL-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C13H14BrN3/c14-11-2-3-12-10(9-11)1-4-13(16-12)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2
(5)Std. InChIKey: MKIHFWMBAKJYJL-UHFFFAOYSA-N