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| CAS No.: | 6909-93-9 |
|---|---|
| Name: | 2,5-DIAMINO-4-PICOLINE |
| Molecular Structure: | |
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| Formula: | C6H9N3 |
| Molecular Weight: | 123.158 |
| Synonyms: | 2,5-Diamino-4-methyl pyridine;2,5-Diamino-4-picoline; |
| Density: | 1.19 g/cm3 |
| Boiling Point: | 333 °C at 760 mmHg |
| Flash Point: | 181.6 °C |
| Hazard Symbols: | R36/37/38:Irritating to eyes, respiratory system and skin.; |
| Risk Codes: | Xi:Irritant; ">  Xi:Irritant; |
| PSA: | 64.93000 |
| LogP: | 1.71680 |
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- Total:16 Page 1 of 1 1
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Specification
The 2,5-Pyridinediamine,4-methyl-, with the CAS registry number 6909-93-9, is also known as 2,5-Diamino-4-methyl pyridine and 2,5-Diamino-4-picoline. It belongs to the product category of Pyridine. This chemical's molecular formula is C6H9N3 and molecular weight is 123. What's more, its IUPAC name is called 4-Methylpyridin-1-ium-2,5-diamine.
Physical properties about 2,5-Pyridinediamine,4-methyl- are: (1)ACD/LogP: -0.01; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.23; (4)ACD/LogD (pH 7.4): -0.09; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.42; (8)ACD/KOC (pH 7.4): 19.58; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 19.37 Å2; (13)Index of Refraction: 1.647; (14)Molar Refractivity: 37.64 cm3; (15)Molar Volume: 103.4 cm3; (16)Surface Tension: 62.2 dyne/cm; (17)Density: 1.19 g/cm3; (18)Flash Point: 181.6 °C; (19)Enthalpy of Vaporization: 57.58 kJ/mol; (20)Boiling Point: 333 °C at 760 mmHg; (21)Vapour Pressure: 0.000141 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: n1cc(N)c(cc1N)C
(2) InChI: InChI=1/C6H9N3/c1-4-2-6(8)9-3-5(4)7/h2-3H,7H2,1H3,(H2,8,9)
(3) InChIKey: HSWAACWBNMVEEW-UHFFFAOYAR