Ethanone,1-(5-hydroxy-2-pyridinyl)- supplier

Name
Ethanone, 1-(5-hydroxy-2-pyridinyl)- (9CI)
EINECS
CAS No. 67310-56-9
Article Data4
CAS DataBase
Density 1.218 g/cm³
Solubility
Melting Point
Formula C₇H₇NO₂
Boiling Point 383.746 °C at 760 mmHg
Molecular Weight 137.138
Flash Point 185.883 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Hydroxy-6-acetylpyridine;6-Acetyl-3-pyridinol;Ethanone, 1-(5-hydroxy-2-pyridinyl)- (9CI);1-(5-hydroxy-pyridin-2-yl)-ethanone;2-Acetyl-5-hydroxypyridine;6-Acetyl-pyridin-3-ol;
PSA 50.19000
LogP 0.98980

Ethanone,1-(5-hydroxy-2-pyridinyl)- Specification

The Ethanone,1-(5-hydroxy-2-pyridinyl)-, with the CAS registry number 67310-56-9, is also known as 3-Hydroxy-6-acetylpyridine. It belongs to the product category of Acetylgroup. This chemical's molecular formula is C₇H₇NO₂ and formula weight is 137.14. What's more, its IUPAC name is 1-(5-hydroxypyridin-2-yl)ethanone.

Physical properties of Ethanone,1-(5-hydroxy-2-pyridinyl)- are: (1)ACD/LogP: 0.53; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.51; (4)ACD/LogD (pH 7.4): 0.365; (5)ACD/BCF (pH 5.5): 1.425; (6)ACD/BCF (pH 7.4): 1.02; (7)ACD/KOC (pH 5.5): 44.393; (8)ACD/KOC (pH 7.4): 31.772; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 50.19 Å²; (13)Index of Refraction: 1.557; (14)Molar Refractivity: 36.254 cm³; (15)Molar Volume: 112.617 cm³; (16)Surface Tension: 51.452 dyne/cm; (17)Density: 1.218 g/cm³; (18)Flash Point: 185.883 °C; (19)Enthalpy of Vaporization: 65.708 kJ/mol; (20)Boiling Point: 383.746 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=NC=C(C=C1)O
(2)InChI: InChI=1S/C7H7NO2/c1-5(9)7-3-2-6(10)4-8-7/h2-4,10H,1H3
(3)InChIKey: WESGRMTVUPBJHT-UHFFFAOYSA-N

Product Name

Ethanone, 1-(5-hydroxy-2-pyridinyl)- (9CI)

Ethanone,1-(5-hydroxy-2-pyridinyl)- Specification

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