5-Acetylquinoline-2,8-diol supplier

Name
5-ACETYL-8-HYDROXY-1H-QUINOLIN-2-ONE
EINECS
CAS No. 62978-73-8
Article Data17
CAS DataBase
Density 1.336 g/cm³
Solubility
Melting Point >260℃
Formula C₁₁H₉NO₃
Boiling Point 509.485 °C at 760 mmHg
Molecular Weight 203.197
Flash Point 261.927 °C
Transport Information
Appearance
Safety
Risk Codes 22-36
Molecular Structure
Hazard Symbols Xn
Synonyms 5-Acetyl-8-hydroxy-1H-quinolin-2-one;5-Acetyl-8-hydroxy-2(1H)-quinolinone;5-Acetyl-8-hydroxycarbostyril;5-Acetyl-8-hydroxyquinolin-2(1H)-one;
PSA 70.42000
LogP 1.84860

5-Acetylquinoline-2,8-diol Specification

The 2(1H)-Quinolinone,5-acetyl-8-hydroxy- with CAS registry number of 62978-73-8 is also called 5-Acetyl-8-hydroxy-1H-quinolin-2-one. Its systematic name is 5-acetyl-8-hydroxyquinolin-2(1H)-one.

Physical properties about this chemical are: (1) ACD/LogP: -0.03; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1; (4) ACD/LogD (pH 7.4): 1; (5) ACD/BCF (pH 5.5): 7; (6) ACD/BCF (pH 7.4): 2; (7) ACD/KOC (pH 5.5): 137; (8) ACD/KOC (pH 7.4): 47; (9) #H bond acceptors: 4; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 66.4 Å²; (13) Index of Refraction: 1.62; (14) Molar Refractivity: 53.419 cm³; (15) Molar Volume: 152.047 cm³; (16) Polarizability: 21.177×10^-24 cm³; (17) Surface Tension: 54.061 dyne/cm; (18) Density: 1.336 g/cm³; (19) Flash Point: 261.927 °C; (20) Enthalpy of Vaporization: 80.953 kJ/mol; (21) Boiling Point: 509.485 °C at 760 mmHg; (22) Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c2ccc(O)c1c2\C=C/C(=O)N1)C;
(2) InChI: InChI=1/C11H9NO3/c1-6(13)7-2-4-9(14)11-8(7)3-5-10(15)12-11/h2-5,14H,1H3,(H,12,15);
(3) InChIKey: PJVZAXRWCFBQFH-UHFFFAOYAR;
(4) Std. InChI: InChI=1S/C11H9NO3/c1-6(13)7-2-4-9(14)11-8(7)3-5-10(15)12-11/h2-5,14H,1H3,(H,12,15);
(5) Std. InChIKey: PJVZAXRWCFBQFH-UHFFFAOYSA-N

Product Name

5-ACETYL-8-HYDROXY-1H-QUINOLIN-2-ONE

5-Acetylquinoline-2,8-diol Specification

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