5-Benzyl-3-pyridinol supplier

Name
5-Benzyl-3-pyridinol
EINECS
CAS No. 52196-90-4
Density 1.154 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₁NO
Boiling Point 423 °C at 760 mmHg
Molecular Weight 185.225
Flash Point 209.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Benzyl-5-hydroxypyridine;5-Benzyl-3-hydroxypyridine;5-Benzyl-3-pyridinol;
PSA 33.12000
LogP 2.37800

5-Benzyl-3-pyridinol Specification

The 5-Benzyl-3-pyridinol with the CAS number 52196-90-4 is also called 3-Pyridinol,5-(phenylmethyl)-. The systematic name is 5-benzylpyridin-3-ol. Its molecular formula is C₁₂H₁₁NO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 5-Benzyl-3-pyridinol are: (1)ACD/LogP: 2.63; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 22.12 Å²; (7)Index of Refraction: 1.608; (8)Molar Refractivity: 55.54 cm³; (9)Molar Volume: 160.4 cm³; (10)Polarizability: 22.01×10^-24cm³; (11)Surface Tension: 50.3 dyne/cm; (12)Enthalpy of Vaporization: 70.35 kJ/mol; (13)Vapour Pressure: 9.36×10^-8mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc(cnc1)Cc2ccccc2
(2)InChI: InChI=1/C12H11NO/c14-12-7-11(8-13-9-12)6-10-4-2-1-3-5-10/h1-5,7-9,14H,6H2
(3)InChIKey: BBQJCGXVQMUHAR-UHFFFAOYAG

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mammal (species unspecified)	LD50	unreported	500mg/kg (500mg/kg)	BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)	Pharmaceutical Chemistry Journal Vol. 16, Pg. 259, 1982

Product Name

5-Benzyl-3-pyridinol

5-Benzyl-3-pyridinol Specification

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