2(1H)-Quinolinone, 4,6,8-trimethyl- supplier

Name
4,6,8-TRIMETHYL-QUINOLIN-2-OL
EINECS
CAS No. 42414-28-8
Article Data2
CAS DataBase
Density 1.084 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₃NO
Boiling Point 350.3 °C at 760 mmHg
Molecular Weight 187.241
Flash Point 207.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbostyril, 4,6,8-trimethyl- (4CI);4,6,8-Trimethyl-2-quinolone;4,6,8-Trimethylcarbostyril;NSC 108501;
PSA 32.86000
LogP 2.45330

2(1H)-Quinolinone, 4,6,8-trimethyl- Specification

The 2(1H)-Quinolinone, 4, 6, 8-trimethyl-, with the CAS registry number of 42414-28-8, is also known as 4, 6, 8-Trimethyl-quinolin-2-ol. This chemical's molecular formula is C₁₂H₁₃NO and molecular weight is 187.2377. What's more, its IUPAC name is 4, 6, 8-Trimethyl-1H-quinolin-2-one.

Physical properties about 2(1H)-Quinolinone, 4, 6, 8-trimethyl- are: (1)ACD/LogP: 2.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.77; (4)ACD/LogD (pH 7.4): 2.77; (5)ACD/BCF (pH 5.5): 75.07; (6)ACD/BCF (pH 7.4): 75.07; (7)ACD/KOC (pH 5.5): 765.73; (8)ACD/KOC (pH 7.4): 765.72; (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: 1.56; (14)Molar Refractivity: 55.86 cm³; (15)Molar Volume: 172.6 cm³; (16)Surface Tension: 37.2 dyne/cm; (17)Density: 1.084 g/cm³; (18)Flash Point: 207.7 °C; (19)Enthalpy of Vaporization: 59.49 kJ/mol; (20)Boiling Point: 350.3 °C at 760 mmHg; (21)Vapour Pressure: 4.42E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2/C=C(\c1c(c(cc(c1)C)C)N2)C
(2) InChI: InChI=1/C12H13NO/c1-7-4-9(3)12-10(5-7)8(2)6-11(14)13-12/h4-6H,1-3H3,(H,13,14)
(3) InChIKey: UHXASMSNKAVYHU-UHFFFAOYAI

Product Name

4,6,8-TRIMETHYL-QUINOLIN-2-OL

2(1H)-Quinolinone, 4,6,8-trimethyl- Specification

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