41394-05-2
Product Name:
Metamitron
Formula:
C10H10N4O
Synonyms:
4-Amino-4,5-dihydro-3-methyl-6-phenyl-1,2,4-triazin-5-one
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | COLOURLESS-TO-YELLOW CRYSTALS. |
|---|---|
| Melting Point | 167 °C |
| Solubility | Solubility in water, g/100ml at 20 °C: 0.17 (slightly soluble) |
| Density | 600 kg/m³ |
| Vapor Pressure | Vapor pressure, Pa at 20 °C: 0.00000086 |
| LogP | 0.83 |
| Ionization Efficiency | Positive |
| Collision Cross Section | 140.93 Ų [M+H]+ [CCS Type: TW] |
| Kovats Retention Index | 2139 |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H311:Acute toxicity,dermal H330:Acute toxicity,inhalation H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
COMPUTED DESCRIPTORS
| Molecular Weight | 202.21 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 202.08546096 g/mol |
| Monoisotopic Mass | 202.08546096 g/mol |
| Topological Polar Surface Area | 71 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 328 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Metamitron is a member of the class of 1,2,4-triazines that is 1,2,4-triazin-5(4H)-one substituted by an amino group at position 4, a methyl group at position 3 and a phenyl group at position 6. It has a role as an environmental contaminant, a xenobiotic and a herbicide.