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1333-53-5

Basic Information
CAS No.: 1333-53-5
Name: 6-ISOPROPYLQUINOLINE
Molecular Structure:
Molecular Structure of 1333-53-5 (6-ISOPROPYLQUINOLINE)
Formula: C12H13 N
Molecular Weight: 171.26
Synonyms: Quinoline,isopropyl- (8CI); Isopropylquinoline; Lichenol
Density: 1.026g/cm3
Melting Point: 73.5-74 °C(Solv: ethanol (64-17-5))
Boiling Point: 279.4°Cat760mmHg
Flash Point: 114.5°C
Safety: Poison by skin contact. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx.
PSA: 12.89000
LogP: 3.35820
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Chemistry

IUPAC Name: 4-propan-2-ylquinoline
Synonyms of Isopropyl quinoline (CAS NO.1333-53-5): 6-Isopropyl quinoline ; EINECS 215-595-4 ; Lichenol ; p-Isopropyl quinoline ; Isopropylquinoline ; Quinoline, (1-methylethyl)- ; Quinoline, isopropyl-
CAS NO: 1333-53-5 
Molecular Formula of Isopropyl quinoline (CAS NO.1333-53-5):  C12H13N
Molecular Weight: 171.2383 
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 12.89 Å2
Index of Refraction: 1.59
Molar Refractivity: 56.37 cm3
Molar Volume: 166.8 cm3
Surface Tension: 40.2 dyne/cm
Density of Isopropyl quinoline (CAS NO.1333-53-5): 1.026 g/cm3
Flash Point: 114.5 °C
Enthalpy of Vaporization: 49.72 kJ/mol
Boiling Point: 279.4 °C at 760 mmHg
Vapour Pressure: 0.00683 mmHg at 25°C
Molecular Structure: 

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 160mg/kg (160mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 821, 1975.
rat LD50 oral 940mg/kg (940mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 821, 1975.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by skin contact. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NOx.