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Name |
3-Pyridinamine,2-bromo-5-methyl- |
EINECS | N/A |
CAS No. | 34552-14-2 | Density | 1.593 g/cm3 |
PSA | 38.91000 | LogP | 2.31590 |
Solubility | N/A | Melting Point |
103-106℃ |
Formula | C6H7BrN2 | Boiling Point | 310 °C at 760 mmHg |
Molecular Weight | 187.04 | Flash Point | 141.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(2-Bromo-5-methylpyridin-3-yl)amine;3-Amino-2-bromo-5-methylpyridine; |
Article Data | 5 |
The 3-Pyridinamine, 2-bromo-5-methyl-, with the CAS registry number of 34552-14-2, is also known as 3-Amino-2-bromo-5-picoline and 2-Bromo-3-amino-5-picoline. It belongs to the product category of Pyridine. This chemical's molecular formula is C6H7BrN2 and molecular weight is 187.04.
Physical properties about 3-Pyridinamine, 2-bromo-5-methyl- are: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.73; (4)ACD/LogD (pH 7.4): 1.73; (5)ACD/BCF (pH 5.5): 12.2; (6)ACD/BCF (pH 7.4): 12.2; (7)ACD/KOC (pH 5.5): 208.54; (8)ACD/KOC (pH 7.4): 208.61; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.91 Å2; (13)Index of Refraction: 1.617; (14)Molar Refractivity: 41.09 cm3; (15)Molar Volume: 117.3 cm3; (16)Polarizability: 16.29×10-24 cm3; (17)Surface Tension: 52 dyne/cm; (18)Density: 1.593 g/cm3; (19)Flash Point: 141.3 °C; (20)Enthalpy of Vaporization: 55.08 kJ/mol; (21)Boiling Point: 310 °C at 760 mmHg; (22)Vapour Pressure: 0.000617 mmHg at 25 °C.
Preparation: this chemical is prepared by 5-Methyl-pyridin-3-ylamine. This reaction needs reagents 48 % HBr and 15 % H2O2. The reaction time is 1 hour with reaction temperature of 70 °C. The yield is about 26 %.
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(c(nc1)Br)N
(2) InChI: InChI=1/C6H7BrN2/c1-4-2-5(8)6(7)9-3-4/h2-3H,8H2,1H3
(3) InChIKey: ODOCHVONAOTFEQ-UHFFFAOYAN