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Name |
2-Quinolinecarboxylicacid, 4-chloro- |
EINECS | N/A |
CAS No. | 15733-82-1 | Density | 1.469 g/cm3 |
PSA | 50.19000 | LogP | 2.58640 |
Solubility | N/A | Melting Point |
170-171℃ |
Formula | C10H6ClNO2 | Boiling Point | 357 °C at 760 mmHg |
Molecular Weight | 207.616 | Flash Point | 169.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Quinaldicacid, 4-chloro- (8CI);2-Carboxy-4-chloroquinoline;4-Chloroquinaldinic acid;NSC 136919; |
Article Data | 5 |
The 2-Quinolinecarboxylicacid, 4-chloro- is an organic compound with the formula C10H6ClNO2. The IUPAC name of this chemical is 4-Chloroquinoline-2-carboxylic acid. With the CAS registry number 15733-82-1, it is also named as 4-Chloroquinoline-2-carboxylicacid. The category of the product is Pharmacetical. Besides, its molecular weight is 207.6131.
The physical properties of 2-Quinolinecarboxylicacid, 4-chloro- are: (1)ACD/LogP: 2.87; (2)ACD/LogD (pH 5.5): 1.01; (3)ACD/LogD (pH 7.4): 0.22; (4)ACD/BCF (pH 5.5): 1.24; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 12.07; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 39.19 Å2; (12)Index of Refraction: 1.69; (13)Molar Refractivity: 54.01 cm3; (14)Molar Volume: 141.2 cm3; (15)Polarizability: 21.41×10-24 cm3; (16)Surface Tension: 66.4 dyne/cm; (17)Density: 1.469 g/cm3; (18)Flash Point: 169.7 °C; (19)Enthalpy of Vaporization: 63.55 kJ/mol; (20)Boiling Point: 357 °C at 760 mmHg; (21)Vapour Pressure: 1.03E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c2ccccc2nc(c1)C(=O)O
(2)InChI: InChI=1/C10H6ClNO2/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8/h1-5H,(H,13,14)
(3)InChIKey: XDHVXNYIJMSNIQ-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C10H6ClNO2/c11-7-5-9(10(13)14)12-8-4-2-1-3-6(7)8/h1-5H,(H,13,14)
(5)Std. InChIKey: XDHVXNYIJMSNIQ-UHFFFAOYSA-N