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| CAS No.: | 81386-30-3 |
|---|---|
| Name: | Sodium perchlorate hydrate |
| Molecular Structure: | |
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| Formula: | C10H10N2O |
| Molecular Weight: | 174.202 |
| Synonyms: | 5-Methyl-3-(4-methylphenyl)-1,2,4-oxadiazole;5-Methyl-3-p-tolyl-1,2,4-oxadiazole; |
| Density: | 1.113 g/cm3 |
| Boiling Point: | 293.4 °C at 760 mmHg |
| Flash Point: | 130.2 °C |
| PSA: | 38.92000 |
| LogP: | 2.35340 |
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Specification
The 1,2,4-Oxadiazole, 5-methyl-3-(4-methylphenyl)-, with the CAS registry number 81386-30-3, is also known as 5-Methyl-3-p-tolyl-1,2,4-oxadiazole. This chemical's molecular formula is C10H10N2O and molecular weight is 174.2. What's more, its systematic name is 5-methyl-3-(4-methylphenyl)-1,2,4-oxadiazole.
Physical properties of 1,2,4-Oxadiazole, 5-methyl-3-(4-methylphenyl)- are: (1)ACD/LogP: 2.74; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 38.92 Å2; (7)Index of Refraction: 1.538; (8)Molar Refractivity: 48.97 cm3; (9)Molar Volume: 156.5 cm3; (10)Polarizability: 19.41×10-24cm3; (11)Surface Tension: 41.8 dyne/cm; (12)Density: 1.113 g/cm3; (13)Flash Point: 130.2 °C; (14)Enthalpy of Vaporization: 51.16 kJ/mol; (15)Boiling Point: 293.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00303 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(onc1c2ccc(cc2)C)C
(2)InChI: InChI=1S/C10H10N2O/c1-7-3-5-9(6-4-7)10-11-8(2)13-12-10/h3-6H,1-2H3
(3)InChIKey: OYGSEQYNSZOSCE-UHFFFAOYSA-N