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| CAS No.: | 858362-82-0 |
|---|---|
| Name: | 2-Bromo-4-pyridinethylamine |
| Molecular Structure: | |
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| Formula: | C6H7BrN2 |
| Molecular Weight: | 187.039 |
| Synonyms: | [(2-Bromopyridin-4-yl)methyl]amine; |
| Density: | 1.574 g/cm3 |
| Boiling Point: | 292.2 °C at 760 mmHg |
| Flash Point: | 130.5 °C |
| PSA: | 38.91000 |
| LogP: | 2.00310 |
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- Total:32 Page 1 of 1 1
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Specification
The 2-Bromopyridine-4-methanamine, with CAS registry number 858362-82-0, belongs to the following product category: Pyridine series. It has the systematic name of (2-bromo-4-pyridyl)methanamine. Besides this, it is also called 1-(2-Bromopyridin-4-yl)methanamine. And the chemical formula of this chemical is C6H7BrN2.
Physical properties of 2-Bromopyridine-4-methanamine: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 38.91 Å2; (7)Index of Refraction: 1.596; (8)Molar Refractivity: 40.48 cm3; (9)Molar Volume: 118.8 cm3; (10)Polarizability: 16.04×10-24cm3; (11)Surface Tension: 51.1 dyne/cm; (12)Enthalpy of Vaporization: 53.17 kJ/mol; (13)Vapour Pressure: 0.00186 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: NCc1ccnc(Br)c1
(2)InChI: InChI=1/C6H7BrN2/c7-6-3-5(4-8)1-2-9-6/h1-3H,4,8H2
(3)InChIKey: OEOAEMBKKWPLSZ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C6H7BrN2/c7-6-3-5(4-8)1-2-9-6/h1-3H,4,8H2
(5)Std. InChIKey: OEOAEMBKKWPLSZ-UHFFFAOYSA-N