Basic Information | Post buying leads | Suppliers |
Name |
5-Bromo-1,3-dimethyl-1H-pyrazole |
EINECS | N/A |
CAS No. | 5744-70-7 | Density | 1.584 g/cm3 |
PSA | 17.82000 | LogP | 1.49100 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H7BrN2 | Boiling Point | 211.748 °C at 760 mmHg |
Molecular Weight | 175.03 | Flash Point | 81.863 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-37 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Pyrazole,5-bromo-1,3-dimethyl- (7CI,8CI);5-Bromo-1,3-dimethylpyrazole; |
The 5-Bromo-1,3-dimethyl-1H-pyrazole is an organic compound with the formula C5H7BrN2. The IUPAC name of this chemical is 5-bromo-1,3-dimethylpyrazole. With the CAS registry number 5744-70-7, it is also named as 1H-Pyrazole, 5-bromo-1,3-dimethyl-. The product's categories are Heterocycle; Building Blocks; Pyrazole.
Physical properties about 5-Bromo-1,3-dimethyl-1H-pyrazole are: (1)ACD/LogP: 0.65; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 7; (5)ACD/BCF (pH 7.4): 7; (6)ACD/KOC (pH 5.5): 137; (7)ACD/KOC (pH 7.4): 137; (8)#H bond acceptors: 2; (9)Polar Surface Area: 17.82 Å2; (10)Index of Refraction: 1.589; (11)Molar Refractivity: 37.231 cm3; (12)Molar Volume: 110.471 cm3; (13)Polarizability: 14.759×10-24cm3; (14)Surface Tension: 38.394 dyne/cm; (15)Density: 1.584 g/cm3; (16)Flash Point: 81.863 °C; (17)Enthalpy of Vaporization: 42.977 kJ/mol; (18)Boiling Point: 211.748 °C at 760 mmHg; (19)Vapour Pressure: 0.261 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(Br)n(C)n1
(2)InChI: InChI=1/C5H7BrN2/c1-4-3-5(6)8(2)7-4/h3H,1-2H3
(3)InChIKey: MGDIZQXZNAILTO-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C5H7BrN2/c1-4-3-5(6)8(2)7-4/h3H,1-2H3
(5)Std. InChIKey: MGDIZQXZNAILTO-UHFFFAOYSA-N