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2-(Quinolin-2-yl)acetic acid

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Name

2-(Quinolin-2-yl)acetic acid

EINECS N/A
CAS No. 284477-00-5 Density 1.297 g/cm3
PSA 50.19000 LogP 1.86190
Solubility N/A Melting Point N/A
Formula C11H9NO2 Boiling Point 365.1 °C at 760 mmHg
Molecular Weight 187.198 Flash Point 174.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 284477-00-5 (2-(Quinolin-2-yl)acetic acid) Hazard Symbols N/A
Synonyms

Quinolin-2-ylacetic acid;

Article Data 4

2-(Quinolin-2-yl)acetic acid Specification

The chemical with CAS registry number of 284477-00-5 is known as 2-(Quinolin-2-yl)acetic acid. The systematic name is Quinolin-2-ylacetic acid. In addition, the formula is C11H9NO2 and the molecular weight is 187.19.

Physical properties about 2-(Quinolin-2-yl)acetic acid are: (1)ACD/LogP: 1.37; (2)ACD/LogD (pH 5.5): -0.74; (3)ACD/LogD (pH 7.4): -1.99; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.02; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.66; (12)Molar Refractivity: 53.3 cm3; (13)Molar Volume: 144.2 cm3; (14)Surface Tension: 61.3 dyne/cm; (15)Density: 1.297 g/cm3; (16)Flash Point: 174.6 °C; (17)Enthalpy of Vaporization: 64.5 kJ/mol; (18)Boiling Point: 365.1 °C at 760 mmHg; (19)Vapour Pressure: 5.69E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: O=C(O)Cc1nc2ccccc2cc1
2. InChI: InChI=1/C11H9NO2/c13-11(14)7-9-6-5-8-3-1-2-4-10(8)12-9/h1-6H,7H2,(H,13,14)
3. InChIKey: FPDPFLYDDGYGKP-UHFFFAOYAM

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