2,4-DIAMINO-6-[2-(2-METHYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE CAS#: 38668-46-1; ChemWhat Code: 360137
Identification
Product Name | 2,4-DIAMINO-6-[2-(2-METHYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE |
IUPAC Name | 6-[2-(2-methylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine |
Molecular Structure | |
CAS Registry Number | 38668-46-1 |
EINECS Number | 254-074-6 |
MDL Number | MFCD00047350 |
Beilstein Registry Number | No data available |
Synonyms | 2,4-diamino-6-[2-(2-methylimidazol-1-yl)ethyl]-1,3,5-triazine |
Molecular Formula | C9H13N7 |
Molecular Weight | 219.24 |
InChI | InChI=1S/C9H13N7/c1-6-12-3-5-16(6)4-2-7-13-8(10)15-9(11)14-7/h3,5H,2,4H2,1H3,(H4,10,11,13,14,15) |
InChI Key | DRQWQDPSMJHCCM-UHFFFAOYSA-N |
Canonical SMILES | Cc1nccn1CCc2nc(nc(n2)N)N |
Patent Information | ||
Patent ID | Title | Publication Date |
EP211121 | Process for synthesizing 2-vinyl-4,6-diamino-s-triazine | 1987 |
US4579946 | Process for synthesis of 2-vinyl-4,6-diamino-S-triazine | 1986 |
Physical Data
Appearance | White crystal |
Solubility | Slightly soluble in methanol, ethanol, DMF; difficult to dissolve in water. |
Flash Point | No data available |
Refractive index | No data available |
Sensitivity | No data available |
Comment (Solubility (MCS)) |
not completely dissolved in methanol; not completely dissolved in methyl ethyl ketone; not completely dissolved in N,N-dimethylformamide |
Spectra
Description (NMR Spectroscopy) | Nucleus (NMR Spectroscopy) | Solvents (NMR Spectroscopy) | Comment (NMR Spectroscopy) |
Chemical shifts | 1H | D2O | |
Spin-spin coupling constants | 1H | D2O | 1H-1H |
Description (IR Spectroscopy) | Solvent (IR Spectroscopy) | Comment (IR Spectroscopy) |
Spectrum | KBr | 4000 – 1600 cm**(-1) |
Route of Synthesis (ROS)
Conditions | Yield |
With tert-butylamine In acetonitrile at 80℃; for 8h; | 92% |
Safety and Hazards
GHS Hazard Statements | Not Classified |
Precautionary Statement Codes | P260, P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P314, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P391, P403+P233, P405, and P501 (The corresponding statement to each P-code can be found at the GHS Classification page.) |
Other Data
Transportation | Under the room temperature and away from light |
HS Code | No data available |
Storage | Imidazole is supplied in 25Kg drum or the user’s appointed packages. It should be stored at room temperature in the original sealed container away from excessive heat and humidity. please avoid acid and oxidant |
Shelf Life | 1 year |
Market Price | USD |
Druglikeness | |
Lipinski rules component | |
Molecular Weight | 219.249 |
logP | -0.842 |
HBA | 7 |
HBD | 2 |
Matching Lipinski Rules | 4 |
Veber rules component | |
Polar Surface Area (PSA) | 108.53 |
Rotatable Bond (RotB) | 3 |
Matching Veber Rules | 2 |
Use Pattern |
It belongs to imidazole type epoxy resin curing agent and accelerator. |
With triazine ring in the molecular structure, has good heat resistance and bright appearance. |
It is mainly used in adhesives, laminating materials, coatings, solder resist inks, powder coatings and prepreg materials for aerospace, especially in the field of powder coatings and adhesives. |
The solubility of the product in epoxy resin is very low, so it can be used as one component latent curing agent. |
The recommendable curing temperature is 120-147 degrees, the latency period is generally 20-40 days, and the gel time at 150 degrees is 100-160 seconds. |
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Approved Manufacturers | |
Warshel Chemical Ltd | http://www.warshel.com/ |
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