Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2(1H)-Pyridinone,3-acetyl- |
EINECS | N/A |
CAS No. | 62838-65-7 | Density | 1.218 g/cm3 |
PSA | 49.93000 | LogP | 0.57750 |
Solubility | N/A | Melting Point |
164 °C(Solv: ligroine (8032-32-4); ethanol (64-17-5)) |
Formula | C7H7NO2 | Boiling Point | 328.725 °C at 760 mmHg |
Molecular Weight | 137.138 | Flash Point | 152.608 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-(2-Hydroxy-3-pyridinyl)ethanone;3-Acetyl-2(1H)-pyridinone;3-Acetyl-2-hydroxypyridine;3-Acetyl-2-pyridone; |
Article Data | 7 |
The CAS register number of 2(1H)-Pyridinone,3-acetyl- is 62838-65-7. It also can be called as 3-Acetyl-2(1H)-pyridinone and the systematic name about this chemical is 1-(2-hydroxy-3-pyridyl)ethanone. The molecular formula about this chemical is C7H7NO2 and the molecular weight is 137.13598. It belongs to the following product category which includes Acetylgroup.
Physical properties about 2(1H)-Pyridinone,3-acetyl- are: (1)ACD/LogP: 0.97; (2)ACD/LogD (pH 5.5): 0.948; (3)ACD/LogD (pH 7.4): 0.942; (4)ACD/BCF (pH 5.5): 3.065; (5)ACD/BCF (pH 7.4): 3.021; (6)ACD/KOC (pH 5.5): 76.683; (7)ACD/KOC (pH 7.4): 75.577; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 50.19 Å2; (12)Index of Refraction: 1.557; (13)Molar Refractivity: 36.254 cm3; (14)Molar Volume: 112.617 cm3; (15)Polarizability: 14.372x10-24cm3; (16)Surface Tension: 51.452 dyne/cm; (17)Density: 1.218 g/cm3; (18)Flash Point: 152.608 °C; (19)Enthalpy of Vaporization: 59.382 kJ/mol; (20)Boiling Point: 328.725 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)c1cccnc1O
(2)InChI: InChI=1/C7H7NO2/c1-5(9)6-3-2-4-8-7(6)10/h2-4H,1H3,(H,8,10)
(3)InChIKey: PYKHYSXTVOVOHV-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C7H7NO2/c1-5(9)6-3-2-4-8-7(6)10/h2-4H,1H3,(H,8,10)
(5)Std. InChIKey: PYKHYSXTVOVOHV-UHFFFAOYSA-N