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5-Quinolinemethanol (16178-42-0)

Identification
Name:5-Quinolinemethanol
Synonyms:(Quinolin-5-yl)methanol;
CAS:16178-42-0
Molecular Formula: C10H9NO
Molecular Weight: 159.18
InChI: InChI=1/C10H9NO/c12-7-8-3-1-5-10-9(8)4-2-6-11-10/h1-6,12H,7H2
Molecular Structure: (C10H9NO) (Quinolin-5-yl)methanol;
Properties
Flash Point: 334.8 °C at 760 mmHg
Boiling Point: 334.8 °C at 760 mmHg
Density:1.218 g/cm3
Refractive index:1.667
Specification:

The IUPAC name of Quinoline-5-methanol is quinolin-5-ylmethanol. With the CAS registry number 16178-42-0, it is also named as 5-(Hydroxymethyl)quinoline. The product's category is quinoline derivertives. Its molecular formula is C10H9NO and its molecular weight is 159.18. 

The other characteristics of Quinoline-5-methanol can be summarized as: (1)ACD/LogP: 0.90 ; (2)# of Rule of 5 Violations: 0 ; (3)H bond acceptors: 2 ; (4)H bond donors: 1 ; (5)Freely Rotating Bonds: 2 ; (6)Topological Polar Surface Area: 33.1 ; (7)Heavy Atom Count: 12 ; (8)Complexity: 149 ; (9)Index of Refraction: 1.667 ; (10)Molar Refractivity: 48.63 cm3 ; (11)Molar Volume: 130.5 cm3 ; (12)Surface Tension: 56.9 dyne/cm ; (13)Density: 1.218 g/cm3 ; (14)Flash Point: 156.3 °C ; (15)Enthalpy of Vaporization: 60.99 kJ/mol ; (16)Boiling Point: 334.8 °C at 760 mmHg ; (17)Vapour Pressure: 4.92E-05 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:OCc1cccc2ncccc12;
(2)InChI:InChI=1/C10H9NO/c12-7-8-3-1-5-10-9(8)4-2-6-11-10/h1-6,12H,7H2;
(3)InChIKey:ZKPMQVSVRVORAH-UHFFFAOYAH;
(4)Std. InChI:InChI=1S/C10H9NO/c12-7-8-3-1-5-10-9(8)4-2-6-11-10/h1-6,12H,7H2;
(5)Std. InChIKey:ZKPMQVSVRVORAH-UHFFFAOYSA-N.

Flash Point: 334.8 °C at 760 mmHg
Safety Data
 

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