3-Pyridinol, 4-phenyl- supplier

Name
3-HYDROXY-4-PHENYLPYRIDINE
EINECS
CAS No. 101925-26-2
Article Data5
CAS DataBase
Density 1.169 g/cm³
Solubility
Melting Point
Formula C₁₁H₉NO
Boiling Point 373.8 °C at 760 mmHg
Molecular Weight 171.199
Flash Point 179.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Hydroxy-4-phenylpyridine;
PSA 33.12000
LogP 2.45420

3-Pyridinol, 4-phenyl- Specification

The 3-Pyridinol, 4-phenyl-, with the CAS registry number 101925-26-2, is also known as 3-Hydroxy-4-phenylpyridine. This chemical's molecular formula is C₁₁H₉NO and formula weight is 171.2. What's more, its IUPAC name is called 4-phenylpyridin-3-ol.

Physical properties of 3-Pyridinol, 4-phenyl-: (1)ACD/LogP: 2.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.83; (4)ACD/LogD (pH 7.4): 1.92; (5)ACD/BCF (pH 5.5): 11.9; (6)ACD/BCF (pH 7.4): 14.56; (7)ACD/KOC (pH 5.5): 160.9; (8)ACD/KOC (pH 7.4): 196.88; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.611; (13)Molar Refractivity: 50.81 cm³; (14)Molar Volume: 146.3 cm³; (15)Surface Tension: 50.2 dyne/cm; (16)Density: 1.169 g/cm³; (17)Flash Point: 179.9 °C; (18)Enthalpy of Vaporization: 64.55 kJ/mol; (19)Boiling Point: 373.8 °C at 760 mmHg; (20)Vapour Pressure: 4.05E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)C2=C(C=NC=C2)O
(2)InChI: InChI=1S/C11H9NO/c13-11-8-12-7-6-10(11)9-4-2-1-3-5-9/h1-8,13H
(3)InChIKey: SSLNVXAJNXCTNE-UHFFFAOYSA-N

Product Name

3-HYDROXY-4-PHENYLPYRIDINE

3-Pyridinol, 4-phenyl- Specification

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