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4-Bromo-7-chloro-8-methylquinoline

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Name

4-Bromo-7-chloro-8-methylquinoline

EINECS N/A
CAS No. 1070879-42-3 Density 1.591 g/cm3
PSA 12.89000 LogP 3.95910
Solubility N/A Melting Point N/A
Formula C10H7BrClN Boiling Point 346.6 °C at 760 mmHg
Molecular Weight 256.52628 Flash Point 163.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1070879-42-3 (4-Bromo-7-chloro-8-methylquinoline) Hazard Symbols N/A
Synonyms

Quinoline, 4-bromo-7-chloro-8-methyl-;

 

4-Bromo-7-chloro-8-methylquinoline Specification

The 4-Bromo-7-chloro-8-methylquinoline, with the CAS registry number of 1070879-42-3, is also known as Quinoline, 4-bromo-7-chloro-8-methyl-. Its molecular formula is C10H7BrClN and molecular weight is 256.52628. What's more, its systematic name is 4-Bromo-7-chloro-8-methyl-quinoline.

Physical properties about the 4-Bromo-7-chloro-8-methylquinoline are: (1)ACD/LogP: 4.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.07; (4)ACD/LogD (pH 7.4): 4.07 ; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 12.89 Å2; (9)Index of Refraction: 1.661; (10)Molar Refractivity: 59.59 cm3; (11)Molar Volume: 161.1 cm3; (12)Surface Tension: 50.3 dyne/cm; (13)Density: 1.591 g/cm3; (14)Flash Point: 163.4 °C; (15)Enthalpy of Vaporization: 56.74 kJ/mol; (16)Boiling Point: 346.6 °C at 760 mmHg; (17)Vapour Pressure: 0.000114 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1c(ccc2c1nccc2Br)Cl
(2) InChI: InChI=1/C10H7BrClN/c1-6-9(12)3-2-7-8(11)4-5-13-10(6)7/h2-5H,1H3
(3) InChIKey: NRJBOHONVONFES-UHFFFAOYAQ

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