Basic information
- Name:
Quinoline,4-(2-phenylethenyl)-
- CAS No.:
4594-84-7
- Molecular Structure:
- Formula:
- C17H13N
- Molecular Weight:
- 231.2918
- Synonyms:
- Quinoline,4-styryl- (6CI,7CI,8CI);Lepidine, α-benzylidene-;NSC 20242;
- Density:
- 1.156 g/cm3
- Boiling Point:
- 397 °C at 760 mmHg
- Flash Point:
- 174.1 °C
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Specification
The Quinoline, 4-(2-phenylethenyl)-, with the CAS registry number of 4594-84-7, is also known as α-Benzylidenelepidine. This chemical's molecular formula is C17H13N and molecular weight is 231.2918. What's more, its IUPAC name is 4-(2-Phenylethenyl)quinoline.
Physical properties about Quinoline, 4-(2-phenylethenyl)- are: (1)ACD/LogP: 4.70; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.89 Å2; (7)Index of Refraction: 1.727; (8)Molar Refractivity: 79.58 cm3; (9)Molar Volume: 199.9 cm3; (10)Surface Tension: 53.1 dyne/cm; (11)Density: 1.156 g/cm3; (12)Flash Point: 174.1 °C; (13)Enthalpy of Vaporization: 62.22 kJ/mol; (14)Boiling Point: 397 °C at 760 mmHg; (15)Vapour Pressure: 3.74E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: n1ccc(c2ccccc12)C=Cc3ccccc3
(2) InChI: InChI=1/C17H13N/c1-2-6-14(7-3-1)10-11-15-12-13-18-17-9-5-4-8-16(15)17/h1-13H
(3) InChIKey: LAAWYSBJZGYHRT-UHFFFAOYAG