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Name	6-Quinolinesulfonic acid	EINECS	604-604-1
CAS No.	65433-95-6	Density	1.499g/cm³
PSA	75.64000	LogP	2.56230
Solubility	N/A	Melting Point	N/A
Formula	C₉H₇ N O₃ S	Boiling Point	268.4°C at 760 mmHg
Molecular Weight	209.225	Flash Point	116.1°C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	NSC 246057;Quinoline-6-sulfonic acid;

6-Quinolinesulfonic acid Specification

The 6-Quinolinesulfonic acid with cas registry number of 65433-95-6, is also called Quinoline-6-sulfonic acid; NSC 246057.

Physical properties of 6-Quinolinesulfonic acid :(1)ACD/LogP: 0.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.01; (4)ACD/LogD (pH 7.4): -3.16; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 64.64 Å²; (13)Index of Refraction: 1.675; (14)Molar Refractivity: 52.45 cm³; (15)Molar Volume: 139.5 cm³; (16)Polarizability: 20.79×10^-24cm³; (17)Surface Tension: 67.9 dyne/cm.

You can still convert the following datas into molecular structure:(1)SMILES:O=S(=O)(O)c1ccc2ncccc2c1; (2)InChI:InChI=1/C9H7NO3S/c11-14(12,13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6H,(H,11,12,13); (3)InChIKey:PLUQFBYKHVFHMZ-UHFFFAOYAS; (4)Std. InChI:InChI=1S/C9H7NO3S/c11-14(12,13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6H,(H,11,12,13); (5)Std. InChIKey:PLUQFBYKHVFHMZ-UHFFFAOYSA-N.

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