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| CAS No.: | 363135-54-0 |
|---|---|
| Name: | 7-Hydroxy-3-quinolinecarbaldehyde |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C10H7NO2 |
| Molecular Weight: | 173.17 |
| Synonyms: | 7-Hydroxy-3-quinolinecarboxaldehyde;7-Hydroxyquinoline-3-carbaldehyde; |
| Density: | 1.364 g/cm3 |
| Boiling Point: | 392.2 °C at 760 mmHg |
| Flash Point: | 191 °C |
| PSA: | 50.19000 |
| LogP: | 1.75290 |
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Specification
The 3-Quinolinecarboxaldehyde, 7-hydroxy-, with the CAS registry number 363135-54-0, is also known as 7-Hydroxy-3-quinolinecarboxaldehyde. This chemical's molecular formula is C10H7NO2 and molecular weight is 173.17. What's more, its systematic name is 7-Hydroxyquinoline-3-carbaldehyde.
Physical properties of 3-Quinolinecarboxaldehyde, 7-hydroxy- are: (1)ACD/LogP: 1.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.37; (4)ACD/LogD (pH 7.4): 1.24; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 50.19 Å2; (9)Index of Refraction: 1.733; (10)Molar Refractivity: 50.82 cm3; (11)Molar Volume: 126.8 cm3; (12)Polarizability: 20.14×10-24 cm3; (13)Surface Tension: 68.7 dyne/cm; (14)Density: 1.364 g/cm3; (15)Flash Point: 191 °C; (16)Enthalpy of Vaporization: 66.7 kJ/mol; (17)Boiling Point: 392.2 °C at 760 mmHg; (18)Vapour Pressure: 1.03E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(cc2c1cc(cn2)C=O)O
(2)InChI: InChI=1S/C10H7NO2/c12-6-7-3-8-1-2-9(13)4-10(8)11-5-7/h1-6,13H
(3)InChIKey: WOPDVNKZIDQIEM-UHFFFAOYSA-N