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| CAS No.: | 51532-07-1 |
|---|---|
| Name: | 2-Bromo-1,5-naphthyridine |
| Article Data: | 4 |
| Molecular Structure: | |
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| Formula: | C8H5BrN2 |
| Molecular Weight: | 209.045 |
| Synonyms: | 2-Bromo-1,5-naphthyridine; |
| Density: | 1.656 g/cm3 |
| Melting Point: | 115-115.5 °C(Solv: ligroine (8032-32-4)) |
| Boiling Point: | 307.4 °C at 760 mmHg |
| Flash Point: | 139.7 °C |
| PSA: | 25.78000 |
| LogP: | 2.39230 |
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Specification
The 1,5-Naphthyridine,2-bromo- is an organic compound with the formula C8H5BrN2. The systematic name of this chemical is 2-bromo-1,5-naphthyridine and the CAS registry Number is 51532-07-1. In addition, the molecular weight is 209.04.
The other characteristics of 1,5-Naphthyridine,2-bromo- can be summarized as: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 25.78 Å2; (7)Index of Refraction: 1.685; (8)Molar Refractivity: 47.96 cm3; (9)Molar Volume: 126.1 cm3; (10)Polarizability: 19.01×10-24 cm3; (11)Surface Tension: 59.1 dyne/cm; (12)Density: 1.656 g/cm3; (13)Flash Point: 139.7 °C; (14)Enthalpy of Vaporization: 52.61 kJ/mol; (15)Boiling Point: 307.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00132 mmHg at 25°C.
People can use the following data to convert to the molecule structure.
1. SMILES:Brc1nc2cccnc2cc1
2. InChI:InChI=1/C8H5BrN2/c9-8-4-3-6-7(11-8)2-1-5-10-6/h1-5H
3. InChIKey:BKYZLQUIVDRXKW-UHFFFAOYAI
4. Std. InChI:InChI=1S/C8H5BrN2/c9-8-4-3-6-7(11-8)2-1-5-10-6/h1-5H
5. Std. InChIKey:BKYZLQUIVDRXKW-UHFFFAOYSA-N