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CAS No.: | 28507-46-2 |
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Name: | 4-CHLORO-2-METHYLQUINOLIN-8-OL |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C10H8ClNO |
Molecular Weight: | 193.633 |
Synonyms: | 2-Methyl-4-chloro-8-hydroxyquinoline;4-Chloro-8-Hydroxy-2-methylquinoline; |
Density: | 1.35 g/cm3 |
Melting Point: | 57-59℃ |
Boiling Point: | 328.368 °C at 760 mmHg |
Flash Point: | 152.392 °C |
PSA: | 33.12000 |
LogP: | 2.90220 |
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The 8-Quinolinol,4-chloro-2-methyl-, with the CAS registry number 28507-46-2, is also known as 4-Chloro-8-Hydroxy-2-methylquinoline. This chemical's molecular formula is C10H8ClNO and formula weight is 193.63. What's more, its IUPAC name is 4-Chloro-8-hydroxy-2-methylquinoline.
Physical properties of 8-Quinolinol,4-chloro-2-methyl- are: (1)ACD/LogP: 3.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.56; (4)ACD/BCF (pH 5.5): 38.37; (5)ACD/BCF (pH 7.4): 38.13; (6)ACD/KOC (pH 5.5): 328.06; (7)ACD/KOC (pH 7.4): 326.02; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 33.12 Å2; (12)Index of Refraction: 1.673; (13)Molar Refractivity: 53.78 cm3; (14)Molar Volume: 143.4 cm3; (15)Surface Tension: 56.8 dyne/cm; (16)Density: 1.35 g/cm3; (17)Flash Point: 152.4 °C; (18)Enthalpy of Vaporization: 59.34 kJ/mol; (19)Boiling Point: 328.4 °C at 760 mmHg; (20)Vapour Pressure: 9.95E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=NC2=C(C=CC=C2O)C(=C1)Cl
(2)InChI: InChI=1S/C10H8ClNO/c1-6-5-8(11)7-3-2-4-9(13)10(7)12-6/h2-5,13H,1H3
(3)InChIKey: BVZOKIGKGBZTOU-UHFFFAOYSA-N