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CAS No.: | 115662-09-4 |
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Name: | 9-Formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C17H23NO2 |
Molecular Weight: | 273.375 |
Synonyms: | 1,1,7,7-Tetramethyl-8-hydroxy-9-formyljulolidine; |
Density: | 1.17 g/cm3 |
Melting Point: | 74-77 °C |
Boiling Point: | 387.2 °C at 760 mmHg |
Flash Point: | 187.9 °C |
Appearance: | Light green crystals |
Safety: | 24/25 |
PSA: | 40.54000 |
LogP: | 3.43870 |
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The 1H,5H-Benzo[ij]quinolizine-9-carboxaldehyde,2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl- is an organic compound with the formula C17H23NO2. The systematic name of this chemical is 8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde. With the CAS registry number 115662-09-4, it is also named as 8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde. The product's category is Quinoline & Isoquinoline. Besides, it is a light green crystals, which should be stored in a closed cool and dry place. When you are using it, avoid contact with skin and eyes.
Physical properties about 1H,5H-Benzo[ij]quinolizine-9-carboxaldehyde,2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl- are: (1)ACD/LogP: 4.74; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 29.54 Å2; (6)Index of Refraction: 1.596; (7)Molar Refractivity: 79.35 cm3; (8)Molar Volume: 232.9 cm3; (9)Polarizability: 31.45×10-24cm3; (10)Surface Tension: 51.1 dyne/cm; (11)Density: 1.17 g/cm3; (12)Flash Point: 187.9 °C; (13)Enthalpy of Vaporization: 66.11 kJ/mol; (14)Boiling Point: 387.2 °C at 760 mmHg; (15)Vapour Pressure: 1.51E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc3c2c(c1O)C(CCN2CCC3(C)C)(C)C
(2)InChI: InChI=1/C17H23NO2/c1-16(2)5-7-18-8-6-17(3,4)13-14(18)12(16)9-11(10-19)15(13)20/h9-10,20H,5-8H2,1-4H3
(3)InChIKey: ZBVWJSQPIHQKQJ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C17H23NO2/c1-16(2)5-7-18-8-6-17(3,4)13-14(18)12(16)9-11(10-19)15(13)20/h9-10,20H,5-8H2,1-4H3
(5)Std. InChIKey: ZBVWJSQPIHQKQJ-UHFFFAOYSA-N