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| CAS No.: | 1122-73-2 |
|---|---|
| Name: | 2-AMINO-4-METHOXY-6-METHYL-1,3,5-TRIAZINE |
| Molecular Structure: | |
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|
|
| Formula: | C5H8N4O |
| Molecular Weight: | 140.14 |
| Synonyms: | 2-Amino-4-methyl-6-methoxy-1, 3, 5-triazine; |
| EINECS: | 216-790-7 |
| Density: | 1.255 g/cm3 |
| Melting Point: | 258-261 °C (lit.) |
| Boiling Point: | 346.4 °C at 760 mmHg |
| Flash Point: | 163.3 °C |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22-36/37/38 |
| Safety: | 26-36 |
| PSA: | 73.92000 |
| LogP: | 0.35200 |
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Specification
The 1, 3, 5-Triazin-2-amine, 4-methoxy-, with the CAS registry number of 1122-73-2, is also known as 2-Amino-4-methyl-6-methoxy-1, 3, 5-triazine. Its EINECS registry number is 216-790-7. This chemical's molecular formula is C5H8N4O and molecular weight is 140.14. What's more, its systematic name is 4-Methoxy-6-methyl-1, 3, 5-triazin-2-amine. It can be used as intermediates to produce sulfonylureas herbicides. Besides, it can be used in sterilization corrosion of paper coatings, polymer emulsion, metal processing liquid.
Physical properties about 1, 3, 5-Triazin-2-amine, 4-methoxy- are: (1)ACD/LogP: 0.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.51; (4)ACD/LogD (pH 7.4): 0.52; (5)ACD/BCF (pH 5.5): 1.45; (6)ACD/BCF (pH 7.4): 1.46; (7)ACD/KOC (pH 5.5): 45.25; (8)ACD/KOC (pH 7.4): 45.59; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 51.14 Å2; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 36.26 cm3; (15)Molar Volume: 111.6 cm3; (16)Surface Tension: 59.3 dyne/cm; (17)Density: 1.255 g/cm3; (18)Flash Point: 163.3 °C; (19)Enthalpy of Vaporization: 59.06 kJ/mol; (20)Boiling Point: 346.4 °C at 760 mmHg; (21)Vapour Pressure: 5.75E-05 mmHg at 25 °C.
Preparation of 1, 3, 5-Triazin-2-amine, 4-methoxy-: this chemical is prepared by reaction of 4-Chloro-[1, 3, 5]triazin-2-ylamine with Methanol; sodium salt at ambient temperature. The reaction needs solvent Methanol. The reaction time is 40 minutes. The yield is about 90 %.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical is harmful if swallowed. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: O(c1nc(nc(n1)N)C)C
(2) InChI: InChI=1/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)
(3) InChIKey: NXFQWRWXEYTOTK-UHFFFAOYAA