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Metamitron · CAS 41394-05-2 · C10H10N4O. UNII H69RGO1QO6. Melting Point: 167 °C; Density: 600 kg/m³; LogP: 0.83.
| CAS Registry Number | 41394-05-2 |
|---|---|
| PubChem CID | 38854 |
| Molecular formula | C10H10N4O |
| IUPAC name | 4-amino-3-methyl-6-phenyl-1,2,4-triazin-5-one |
| UNII (FDA) | H69RGO1QO6 |
| Molecular Weight | 202.21 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 202.08546096 |
| Monoisotopic Mass | 202.08546096 |
| Topological Polar Surface Area | 71.1 |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Melting Point | 167 °C |
|---|---|
| Density | 600 kg/m³ |
| LogP | 0.83 |
| LogP | 0.98 |
| Ionization Efficiency | 3.2 |
| Ionization Efficiency | 2.7 |
| Ionization Efficiency | MeCN (80%) |
| Ionization Efficiency | DOI:10.1038/s41598-020-62573-z |
| Collision Cross Section | 142.33 Ų [M+H]+ |
| Collision Cross Section | 141.96 Ų [M-H]- |
| Reported hazard statements | H302, H400, H332 (34.3%) |
|---|
H302: Harmful if swallowed [Warning Acute toxicity, oral]
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
METAMITRON; 41394-05-2; Goltix; 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one; 1,2,4-Triazin-5(4H)-one, 4-amino-3-methyl-6-phenyl-; DTXSID7047568; H69RGO1QO6; 4-Amino-4,5-dihydro-3-methyl-6-phenyl-1,2,4-triazin-5-one; CHEBI:6791; DTXCID5027568; RefChem:156784; 255-349-3; 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5-one; Herbrak; Metamiton; Metamitron [German]
CAS 41394-05-2; molecular formula C10H10N4O; molecular weight — g/mol.
METAMITRON, 41394-05-2, Goltix, 4-Amino-3-methyl-6-phenyl-1,2,4-triazin-5(4H)-one, 1,2,4-Triazin-5(4H)-one, 4-amino-3-methyl-6-phenyl-, DTXSID7047568.
Hazard statements reported: H302, H400, H332.
Melting Point: 167 °C; Density: 600 kg/m³; LogP: 0.83; LogP: 0.98.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.