4-Quinolinol,7-chloro-2,8-dimethyl- supplier

Name
7-CHLORO-2,8-DIMETHYL-4-QUINOLINOL
EINECS
CAS No. 21629-48-1
Article Data2
CAS DataBase
Density 1.233 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₀ClNO
Boiling Point 329.5 °C at 760 mmHg
Molecular Weight 207.659
Flash Point 153.1 °C
Transport Information
Appearance
Safety 26-39-45
Risk Codes 25-41
Molecular Structure
Hazard Symbols Xi
Synonyms Chlorodimethylhydroxyquinoline;
PSA 33.12000
LogP 3.21060

4-Quinolinol,7-chloro-2,8-dimethyl- Specification

The 4-Quinolinol,7-chloro-2,8-dimethyl-, with the CAS registry number of 21629-48-1, is also known as Chlorodimethylhydroxyquinoline. This chemical's molecular formula is C₁₁H₁₀ClNO and molecular weight is 207.66. What's more, its IUPAC name is 7-Chloro-2,8-dimethyl-1H-quinolin-4-one.

Physical properties about the 4-Quinolinol,7-chloro-2,8-dimethyl- are: (1)ACD/LogP: 4.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.95; (4)ACD/LogD (pH 7.4): 1.96; (5)ACD/BCF (pH 5.5): 5.43; (6)ACD/BCF (pH 7.4): 5.49; (7)ACD/KOC (pH 5.5): 28.32; (8)ACD/KOC (pH 7.4): 28.63; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 55.93 cm³; (15)Molar Volume: 168.2 cm³; (16)Surface Tension: 40.7 dyne/cm; (17)Density: 1.233 g/cm³; (18)Flash Point: 153.1 °C; (19)Enthalpy of Vaporization: 57.2 kJ/mol; (20)Boiling Point: 329.5 °C at 760 mmHg; (21)Vapour Pressure: 0.000176 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc2c(c1C)N/C(=C\C2=O)C
(2) InChI: InChI=1/C11H10ClNO/c1-6-5-10(14)8-3-4-9(12)7(2)11(8)13-6/h3-5H,1-2H3,(H,13,14)
(3) InChIKey: LOJPYUFGOCWEHF-UHFFFAOYAZ

Product Name

7-CHLORO-2,8-DIMETHYL-4-QUINOLINOL

4-Quinolinol,7-chloro-2,8-dimethyl- Specification

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