- 5-Bromo-2-methylpyrimidine
- 5-Bromo-2-methylpyrimidine-4-carboxylic acid
- 5-Bromo-2-methylpyrimidine-4-carboxylic acid ethyl ester
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Cas Database |
| Name |
5-Bromo-2-methylpyrimidine |
EINECS | 691-361-9 |
| CAS No. | 7752-78-5 | Density | 1.597 g/cm3 |
| PSA | 25.78000 | LogP | 1.54750 |
| Solubility | N/A | Melting Point |
80.0 to 85.0 °C |
| Formula | C5H5BrN2 | Boiling Point | 195.25 °C at 760 mmHg |
| Molecular Weight | 173.012 | Flash Point | 71.885 °C |
| Transport Information | N/A | Appearance | 59 - 60 °C (EtOAc), 83 - 84 °C (aq. ethanol) |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
2-Methyl-5-bromopyrimidine; |
Article Data | 15 |
5-Bromo-2-methylpyrimidine Specification
The cas register number of 5-Bromo-2-methylpyrimidine is 7752-78-5. It also can be called as 2-Methyl-5-bromopyrimidine and the IUPAC Name about this chemical is 5-bromo-2-methylpyrimidine. It belongs to the Pyridines, Pyrimidines, Purines and Pteredines.
Physical properties about 5-Bromo-2-methylpyrimidine are: (1)ACD/LogP: 1.04; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 2; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 59; (7)ACD/KOC (pH 7.4): 59; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78Å2; (10)Index of Refraction: 1.558; (11)Molar Refractivity: 34.95 cm3; (12)Molar Volume: 108.341 cm3; (13)Polarizability: 13.855x10-24cm3; (14)Surface Tension: 47.025 dyne/cm; (15)Enthalpy of Vaporization: 41.38 kJ/mol; (16)Vapour Pressure: 0.593 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=NC=C(C=N1)Br
(2)InChI: InChI=1S/C5H5BrN2/c1-4-7-2-5(6)3-8-4/h2-3H,1H3
(3)InChIKey: NEDJTEXNSTUKHW-UHFFFAOYSA-N
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