Basic Information | Post buying leads | Suppliers |
Name |
4-Quinolinecarboxylicacid, 2-(2-naphthalenyl)- |
EINECS | N/A |
CAS No. | 13605-87-3 | Density | 1.308 g/cm3 |
PSA | 50.19000 | LogP | 4.75320 |
Solubility | N/A | Melting Point |
N/A |
Formula | C20H13NO2 | Boiling Point | 527.2 °C at 760 mmHg |
Molecular Weight | 299.329 | Flash Point | 272.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(2-Naphthyl)quinoline-4-carboxylic acid; |
The 4-Quinolinecarboxylicacid, 2-(2-naphthalenyl)-, with the CAS registry number 13605-87-3, is also known as 2-(2-Naphthyl)quinoline-4-carboxylic acid. This chemical's molecular formula is C20H13NO2 and molecular weight is 299.32. What's more, its systematic name is 2-(Naphthalen-2-yl)quinoline-4-carboxylic acid.
Physical properties about 4-Quinolinecarboxylicacid, 2-(2-naphthalenyl)- are: (1)ACD/LogP: 4.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.57; (4)ACD/LogD (pH 7.4): 2.08; (5)ACD/BCF (pH 5.5): 12.08; (6)ACD/BCF (pH 7.4): 3.99; (7)ACD/KOC (pH 5.5): 36.39; (8)ACD/KOC (pH 7.4): 12.03; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 39.19 Å2; (13)Index of Refraction: 1.732; (14)Molar Refractivity: 91.55 cm3; (15)Molar Volume: 228.7 cm3; (16)Polarizability: 36.29×10-24 cm3; (17)Surface Tension: 63 dyne/cm; (18)Density: 1.308 g/cm3; (19)Flash Point: 272.7 °C; (20)Enthalpy of Vaporization: 84.4 kJ/mol; (21)Boiling Point: 527.2 °C at 760 mmHg; (22)Vapour Pressure: 6.05E-12 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1c4ccccc4nc(c1)c3cc2ccccc2cc3
(2) InChI: InChI=1/C20H13NO2/c22-20(23)17-12-19(21-18-8-4-3-7-16(17)18)15-10-9-13-5-1-2-6-14(13)11-15/h1-12H,(H,22,23)
(3) InChIKey: LLMCWSJMTWWINZ-UHFFFAOYAP