3-Pyridinemethanol,6-phenoxy- supplier

Name
(6-PHENOXY-3-PYRIDINYL)METHANOL
EINECS
CAS No. 101990-68-5
Density 1.204g/cm³
Solubility
Melting Point
Formula C₁₂H₁₁NO₂
Boiling Point 362.9 °C at 760 mmHg
Molecular Weight 201.22
Flash Point 173.3 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols Xi
Synonyms (6-Phenoxypyridin-3-yl)methanol;6-Phenoxy-3-pyridinemethanol;
PSA 42.35000
LogP 2.36620

3-Pyridinemethanol,6-phenoxy- Specification

The 3-Pyridinemethanol,6-phenoxy-, with CAS registry number 101990-68-5, has the systematic name of (6-phenoxypyridin-3-yl)methanol. Besides this, it is also called (6-phenoxy-3-pyridyl)methan-1-ol. And the chemical formula of this chemical is C₁₂H₁₁NO₂.

Physical properties of 3-Pyridinemethanol,6-phenoxy-: (1)ACD/LogP: 1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.2; (4)ACD/LogD (pH 7.4): 1.2; (5)ACD/BCF (pH 5.5): 4.84; (6)ACD/BCF (pH 7.4): 4.84; (7)ACD/KOC (pH 5.5): 107.61; (8)ACD/KOC (pH 7.4): 107.65; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 31.35 Å²; (13)Index of Refraction: 1.601; (14)Molar Refractivity: 57.23 cm³; (15)Molar Volume: 167 cm³; (16)Polarizability: 22.69×10^-24cm³; (17)Surface Tension: 50.8 dyne/cm; (18)Density: 1.204 g/cm³; (19)Flash Point: 173.3 °C; (20)Enthalpy of Vaporization: 64.24 kJ/mol; (21)Boiling Point: 362.9 °C at 760 mmHg; (22)Vapour Pressure: 6.69E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccccc1)c2ncc(cc2)CO
(2)InChI: InChI=1/C12H11NO2/c14-9-10-6-7-12(13-8-10)15-11-4-2-1-3-5-11/h1-8,14H,9H2
(3)InChIKey: ZAKRVFYNLKKPOF-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C12H11NO2/c14-9-10-6-7-12(13-8-10)15-11-4-2-1-3-5-11/h1-8,14H,9H2
(5)Std. InChIKey: ZAKRVFYNLKKPOF-UHFFFAOYSA-N

Product Name

(6-PHENOXY-3-PYRIDINYL)METHANOL

3-Pyridinemethanol,6-phenoxy- Specification

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