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Name |
3(2H)-Pyridazinone,4-methyl-6-phenyl- |
EINECS | 236-322-5 |
CAS No. | 13300-09-9 | Density | 1.17 g/cm3 |
PSA | 46.01000 | LogP | 2.15760 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H10N2O | Boiling Point | N/A |
Molecular Weight | 186.213 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Methyl-6-phenylpyridazin-3(2H)-one;4-Methyl-6-phenyl-2,3-dihydropyridazine-3-one;4-Methyl-6-phenyl-3(2H)-pyridazinone; |
Article Data | 23 |
The 3(2H)-Pyridazinone,4-methyl-6-phenyl- with CAS registry number of 13300-09-9 is also known as 4-Methyl-6-phenyl-2,3-dihydropyridazine-3-one and 4-Methyl-6-phenyl-3(2H)-pyridazinone. Its EINECS register number is 236-322-5. The IUPAC name is 5-Methyl-3-phenyl-1H-pyridazin-6-one. In addition, the formula is C11H10N2O and the molecular weight is 186.21.
Physical properties about this chemical are: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.57; (4)ACD/LogD (pH 7.4): 1.57; (5)ACD/BCF (pH 5.5): 9.23; (6)ACD/BCF (pH 7.4): 9.22; (7)ACD/KOC (pH 5.5): 170.76; (8)ACD/KOC (pH 7.4): 170.73; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 32.67Å2; (13)Index of Refraction: 1.609; (14)Molar Refractivity: 54.91 cm3; (15)Molar Volume: 158.4 cm3; (16)Polarizability: 21.76×10-24cm3; (17)Surface Tension: 43.5 dyne/cm; (18)Density: 1.17 g/cm3; (19)Vapour Pressure: mmHg at 25°C.
You can still convert the following datas into molecular structure:
1. SMILES: O=C1/C(=C\C(=N/N1)\c2ccccc2)C
2. InChI: InChI=1/C11H10N2O/c1-8-7-10(12-13-11(8)14)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14)
3. InChIKey: HNZITGUYCFHIMD-UHFFFAOYAW
4. Std. InChI: InChI=1S/C11H10N2O/c1-8-7-10(12-13-11(8)14)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14)
5. Std. InChIKey: HNZITGUYCFHIMD-UHFFFAOYSA-N