Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-Hydroxy-5,6-dimethylnicotinonitrile |
EINECS | N/A |
CAS No. | 72716-80-4 | Density | 1.16 g/cm3 |
PSA | 56.65000 | LogP | 0.86338 |
Solubility | N/A | Melting Point |
270 °C |
Formula | C8H8N2O | Boiling Point | 335.6 °C at 760 mmHg |
Molecular Weight | 148.164 | Flash Point | 156.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Hydroxy-3-cyano-5,6-dimethylpyridine;2-Hydroxy-5,6-dimethyl-3-pyridinecarbonitrile;3-Cyano-5,6-dimethyl-2(1H)-pyridone;3-Cyano-5,6-dimethylpyrid-2-one;3-Cyano-5,6-dimethylpyridin-2-ol;5,6-Dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile; |
Article Data | 20 |
This chemical is called 2-Hydroxy-5,6-dimethylnicotinonitrile, and it can also be named as 5,6-Dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile. With the molecular formula of C8H8N2O, its molecular weight is 148.16. The CAS registry number of this chemical is 72716-80-4, and its product category is Nitrile.
Other characteristics of the 2-Hydroxy-5,6-dimethylnicotinonitrile can be summarised as followings: (1)ACD/LogP: 0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 0.29; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 34.26; (8)ACD/KOC (pH 7.4): 33.96; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 44.1 Å2; (13)Index of Refraction: 1.539; (14)Molar Refractivity: 39.88 cm3; (15)Molar Volume: 127.2 cm3; (16)Polarizability: 15.81×10-24cm3; (17)Surface Tension: 43.9 dyne/cm; (18)Density: 1.16 g/cm3; (19)Flash Point: 156.8 °C; (20)Enthalpy of Vaporization: 57.87 kJ/mol; (21)Boiling Point: 335.6 °C at 760 mmHg; (22)Vapour Pressure: 0.000119 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: N#C\C1=C\C(=C(/NC1=O)C)C
2.InChI: InChI=1/C8H8N2O/c1-5-3-7(4-9)8(11)10-6(5)2/h3H,1-2H3,(H,10,11)
3.InChIKey: BUGNNHLZTBPABI-UHFFFAOYAR