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| CAS No.: | 1569-16-0 |
|---|---|
| Name: | 2-METHYL-[1,8]NAPHTHYRIDINE |
| Molecular Structure: | |
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| Formula: | C9H8N2 |
| Molecular Weight: | 144.176 |
| Synonyms: | 2-Methyl-1,8-naphthyridine;2-Methylnaphthyridine; |
| Density: | 1.142 g/cm3 |
| Melting Point: | 96-97 °C |
| Boiling Point: | 252.835 °C at 760 mmHg |
| Flash Point: | 106.326 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | Xi:; ">  Xi:; |
| Safety: | 26-39 |
| PSA: | 25.78000 |
| LogP: | 1.93820 |
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Specification
This chemical is called 2-Methyl-[1,8]naphthyridine, and it can also be named as 1,8-naphthyridine, 2-methyl-. With the molecular formula of C9H8N2, its molecular weight is 144.17. The CAS registry number of this chemical is 1569-16-0. In addition, this chemical is irritant, please be careful when you use it.
Other characteristics of the 2-Methyl-[1,8]naphthyridine can be summarised as followings: (1)ACD/LogP: 1.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.36; (4)ACD/LogD (pH 7.4): 1.38; (5)ACD/BCF (pH 5.5): 6.24; (6)ACD/BCF (pH 7.4): 6.54; (7)ACD/KOC (pH 5.5): 127.21; (8)ACD/KOC (pH 7.4): 133.53; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.633; (14)Molar Refractivity: 45.1 cm3; (15)Molar Volume: 126.2 cm3; (16)Polarizability: 17.88×10-24cm3; (17)Surface Tension: 50.7 dyne/cm; (18)Density: 1.141 g/cm3; (19)Flash Point: 106.3 °C; (20)Enthalpy of Vaporization: 47.04 kJ/mol; (21)Boiling Point: 252.8 °C at 760 mmHg; (22)Vapour Pressure: 0.0301 mmHg at 25°C.
Uses of this chemical: The 2-Methyl-[1,8]naphthyridine could react with 2-trichloromethyl-[1,8]naphthyridine , and obtain the 6-chloro-2-trichloromethyl-[1,8]naphthyridine. This reaction needs the reagents of N-chlorosuccinimide, 2,2'-dicyano-2,2'-azopropane, and the solvent of CH2Cl2. The yield is 94 %. In addition, the other condition is heating.
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You can still convert the following datas into molecular structure:
1.SMILES: n1cccc2c1nc(cc2)C
2.InChI: InChI=1/C9H8N2/c1-7-4-5-8-3-2-6-10-9(8)11-7/h2-6H,1H3
3.InChIKey: FSWRUYCICUXURT-UHFFFAOYAE