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CAS No.: | 46185-24-4 |
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Name: | 1,2,3,4-TETRAHYDRO-QUINOLINE-2-CARBOXYLIC ACID |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C10H11NO2 |
Molecular Weight: | 177.203 |
Synonyms: | 1,2,3,4-Tetrahydroquinoline-2-carboxylicacid;1,2,3,4-Tetrahydroquinoline-2-carboxylic acid; |
Density: | 1.226 g/cm3 |
Melting Point: | 112-113 °C |
Boiling Point: | 392.598 °C at 760 mmHg |
Flash Point: | 191.237 °C |
PSA: | 49.33000 |
LogP: | 1.63590 |
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The 2-Quinolinecarboxylicacid, 1,2,3,4-tetrahydro- is an organic compound with the formula C10H11NO2. The systematic name of this chemical is 1,2,3,4-Tetrahydroquinoline-2-carboxylic acid. With the CAS registry number 46185-24-4, it is also named as 1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid. Besides, its molecular weight is 177.2.
The physical properties of 2-Quinolinecarboxylicacid, 1,2,3,4-tetrahydro- are: (1)ACD/LogP: 1.64; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 49.33 Å2; (10)Index of Refraction: 1.577; (11)Molar Refractivity: 47.883 cm3; (12)Molar Volume: 144.545 cm3; (13)Polarizability: 18.982×10-24 cm3; (14)Surface Tension: 48.27 dyne/cm; (15)Density: 1.226 g/cm3; (16)Flash Point: 191.237 °C; (17)Enthalpy of Vaporization: 67.749 kJ/mol; (18)Boiling Point: 392.598 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)C1CCc2ccccc2N1
(2)InChI: InChI=1/C10H11NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-4,9,11H,5-6H2,(H,12,13)
(3)InChIKey: OSJVTYVKQNOXPP-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C10H11NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-4,9,11H,5-6H2,(H,12,13)
(5)Std. InChIKey: OSJVTYVKQNOXPP-UHFFFAOYSA-N