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Cas Database |
| Name |
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid |
EINECS | 201-673-5 |
| CAS No. | 86-47-5 | Density | 1.549 g/cm3 |
| PSA | 70.42000 | LogP | 2.29200 |
| Solubility | N/A | Melting Point |
250 °C (dec.)(lit.) |
| Formula | C10H6 Cl N O3 | Boiling Point | 395 °C at 760 mmHg |
| Molecular Weight | 223.616 | Flash Point | 192.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 26-36 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
4-Hydroxy-7-chloro-3-quinolinecarboxylicacid; 7-Chloro-4-hydroxyquinoline-3-carboxylic acid; NSC 27801; NSC 56803 |
Article Data | 12 |
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid Chemical Properties
IUPAC Name: 7-chloro-4-oxo-1H-quinoline-3-carboxylic acid
Empirical Formula: C10H6ClNO3
Molecular Weight: 223.6125g/mol
EINECS: 201-673-5
Structure of 4-Hydroxy-7-chloro-3-quinolinecarboxylic acid (CAS NO.86-47-5):
Index of Refraction: 1.648
Molar Refractivity: 52.5 cm3
Molar Volume: 144.2 cm3
Polarizability: 20.81×10-24cm3
Surface Tension: 64.7 dyne/cm
Density: 1.549 g/cm3
Flash Point: 192.7 °C
Enthalpy of Vaporization: 68.04 kJ/mol
Boiling Point: 395 °C at 760 mmHg
Vapour Pressure: 6E-07 mmHg at 25°C
Product Categories: Building Blocks;Halogenated Heterocycles;Heterocyclic Building Blocks;Quinolines;QuinolinesHeterocyclic Building Blocks
SMILES: Clc1ccc2c(c1)N/C=C(\C2=O)C(=O)O
InChI: InChI=1/C10H6ClNO3/c11-5-1-2-6-8(3-5)12-4-7(9(6)13)10(14)15/h1-4H,(H,12,13)(H,14,15)
InChIKey: SACLIBNEKWTDEG-UHFFFAOYAO
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | National Technical Information Service. Vol. AD277-689, |
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
RTECS: VB1950000
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid Specification
4-Hydroxy-7-chloro-3-quinolinecarboxylic acid , its cas register number is 86-47-5. It also can be called 3-Carboxy-4-hydroxy-7-chloroquinoline ; 5-22-05-00286 (Beilstein Handbook Reference) ; 7-Chloro-4-hydroxy-3-quinolinecarboxylic acid ; AI3-23857 ; BRN 0171561 ; EINECS 201-673-5 ; NSC 27801 ; Quinoline, 3-carboxy-4-hydroxy-7-chloro- ;
USAF KF-16 .
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