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1201-07-6

Basic Information
CAS No.: 1201-07-6
Name: 8-BROMO-4-CHLORO-2-METHYLQUINOLINE
Article Data: 3
Molecular Structure:
Molecular Structure of 1201-07-6 (8-BROMO-4-CHLORO-2-METHYLQUINOLINE)
Formula: C10H7BrClN
Molecular Weight: 256.529
Synonyms: Quinaldine,8-bromo-4-chloro- (7CI,8CI);
Density: 1.591 g/cm3
Boiling Point: 321.854 °C at 760 mmHg
Flash Point: 148.452 °C
Hazard Symbols: T
Risk Codes: 25-41
Safety: 26-39-45
PSA: 12.89000
LogP: 3.95910
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Specification

The 8-Bromo-4-chloro-2-methylquinoline, with the CAS registry number 1201-07-6, is also known as 8-Bromo-4-chloro-2-methyl-quinoline and Quinoline, 8-bromo-4-chloro-2-methyl-. This chemical's molecular formula is C10H7BrClN and molecular weight is 256.53. What's more, both its IUPAC name and systematic name are the same which is called 8-Bromo-4-chloro-2-methylquinoline.

Physical properties about 8-Bromo-4-chloro-2-methylquinoline are: (1) ACD/LogP: 4.01; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 1; (4) #H bond donors: 0; (5) #Freely Rotating Bonds: 0; (6) Polar Surface Area: 12.89 Å2; (7) Index of Refraction: 1.661; (8) Molar Refractivity: 59.59 cm3; (9) Molar Volume: 161.1 cm3; (10) Surface Tension: 50.3 dyne/cm; (11) Density: 1.591 g/cm3; (12) Flash Point: 148.5 °C; (13) Enthalpy of Vaporization: 54.12 kJ/mol; (14) Boiling Point: 321.9 °C at 760 mmHg; (15) Vapour Pressure: 0.000546 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cccc2c(Cl)cc(nc12)C
(2) InChI: InChI=1/C10H7BrClN/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3
(3) InChIKey: SDVHWORPDUOWDV-UHFFFAOYAD