Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Quinolinecarboxaldehyde,6-bromo-2-chloro- |
EINECS | N/A |
CAS No. | 73568-35-1 | Density | 1.728 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
188-189℃ |
Formula | C10H5BrClNO | Boiling Point | 389.834 °C at 760 mmHg |
Molecular Weight | 270.513 | Flash Point | 189.565 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26 | Risk Codes | 22-36 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
6-Bromo-2-chloroquinoline-3-carboxaldehyde; |
Article Data | 29 |
The 3-Quinolinecarboxaldehyde,6-bromo-2-chloro-, with the CAS registry number 73568-35-1, is also known as 2-Chloro-6-bromoquinoline-3-carboxaldehyde. This chemical's molecular formula is C10H5BrClNO and molecular weight is 270.5098. What's more, its systematic name is called 6-Bromo-2-chloroquinoline-3-carbaldehyde.
Physical properties about 3-Quinolinecarboxaldehyde,6-bromo-2-chloro- are: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 223; (6)ACD/BCF (pH 7.4): 223; (7)ACD/KOC (pH 5.5): 1670; (8)ACD/KOC (pH 7.4): 1670; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.96 Å2; (13)Index of Refraction: 1.715; (14)Molar Refractivity: 61.525 cm3; (15)Molar Volume: 156.574 cm3; (16)Surface Tension: 60.5 dyne/cm; (17)Density: 1.728 g/cm3; (18)Flash Point: 189.565 °C; (19)Enthalpy of Vaporization: 63.923 kJ/mol; (20)Boiling Point: 389.834 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc2nc(Cl)c(cc2c1)C=O
(2) InChI: InChI=1/C10H5BrClNO/c11-8-1-2-9-6(4-8)3-7(5-14)10(12)13-9/h1-5H
(3) InChIKey: DCZCMZVZWKXJAF-UHFFFAOYAF