CAS No.2176-45-6,3-Phenoxypyridine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2176-45-6
Name:	3-Phenoxypyridine
Article Data:	19

Formula:	C₁₁H₉NO
Molecular Weight:	171.199
Synonyms:	3-Phenoxypyridine;CI 844;
Density:	1.117 g/cm³
Boiling Point:	274.4 °C at 760 mmHg
Flash Point:	100.6 °C
PSA:	22.12000
LogP:	2.87390

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Specification

The 3-Phenoxypyridine, with the CAS registry number 2176-45-6, is also known as Pyridine, 3-phenoxy-. This chemical's molecular formula is C₁₁H₉NO and molecular weight is 171.19. Its IUPAC name is called 3-phenoxypyridine. This chemical's classification code is Drug / Therapeutic Agent.

Physical properties of 3-Phenoxypyridine: (1)ACD/LogP: 2.72; (2)#H bond acceptors: 2; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 2; (5)Index of Refraction: 1.577; (6)Molar Refractivity: 50.78 cm³; (7)Molar Volume: 153.2 cm³; (8)Surface Tension: 43 dyne/cm; (9)Density: 1.117 g/cm³; (10)Flash Point: 100.6 °C; (11)Enthalpy of Vaporization: 49.22 kJ/mol; (12)Boiling Point: 274.4 °C at 760 mmHg; (13)Vapour Pressure: 0.00906 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)OC2=CN=CC=C2
(2)InChI: InChI=1S/C11H9NO/c1-2-5-10(6-3-1)13-11-7-4-8-12-9-11/h1-9H
(3)InChIKey: KDGUIKPOZGYLQJ-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	400mg/kg (400mg/kg)		United States Patent Document. Vol. #4859663,