Basic information
- CAS
6420-47-9- Standard SMILES
CCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O.OCCN(CCO)CCO- InChIKey
YRKPPLCJMDGOOY-UHFFFAOYSA-N- Molecular formula
- C16H27N3O8
- Average molar mass
- 389.4 g/mol
- Monoisotopic mass
- 389.17981483
Names & identifiers
- Preferred name
- Dinoseb-trolamine
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;2-butan-2-yl-4,6-dinitrophenol
- English name
- 2-sec-Butyl-4,6-dinitrophenol triethanolamine salt
- Molecular formula
- C16H27N3O8
- Molecular weight
- 389.4
Names & synonyms
Dinoseb-trolamine6420-47-9dinoseb triethanolamine saltR100VW5Z1OCHEMOX DNDTXSID5034989DN-289RefChem:134484DTXCID3014989229-166-42-sec-Butyl-4,6-dinitrophenol triethanolamine saltDinoseb-trolamine [ISO]
Show more names
ol](1:1)GEBOTOX(R)dinoseb,triethanolaminesaltdinitrobutylphenol2,2’,2’’-nitrilotriethanolsalto-sec-butyl-4,6-dinitrophenoltriethanolaminesaltTriethanolammonium 2,4-dinitro-6-(1-methylpropyl)phenolate2-(1-methyl-n-propyl)-4,6-dinitrophenoltriethanolaminesalt2-sec-butyl-4,6-dinitrophenol2,2’,2’’-nitrilotriethanolsalt
2-[bis(2-hydroxyethyl)amino]ethanol;2-butan-2-yl-4,6-dinitrophenolCaswell No. 128EEINECS 229-166-4EPA Pesticide Chemical Code 037506UNII-R100VW5Z1O2-(1-Methyl-n-propyl)-4,6-dinitrophenol triethanolamine saltDinitrobutylphenol 2,2',2''-nitrilotriethanol salto-sec-Butyl-4,6-dinitrophenol triethanolamine salt
Database identifiers
- CAS
6420-47-9
Properties
Computed structural properties
- Topological polar surface area
- 176 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- Boiling point
- 514.87 °C · 514.87°C (rough estimate)
- Density
- 1.1907 · 1.1907 (rough estimate)
- refractive index
- 1.65 · 1.6500 (estimate)
- form
- Liquid or semi-solid
- color
- Brown
- FDA UNII
- 100 VW5Z1O · R100VW5Z1O
- EPA Substance Registry System
- Dinoseb triethanolamine salt (6420-47-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H300: Fatal if swallowed [Danger Acute toxicity, oral]
P262, P264, P270, P280, P301+P316, P302+P352, P316, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)
Hazard information
Other Safety InformationIMAP assessments - Phenol, 2-(1-methylpropyl)-4,6-dinitro-, compound with 2,2',2''-nitrilotris[ethanol] (1:1): Environment tier I assessment
Hazard Classes and CategoriesAcute toxicity (Oral) - Category 2
Safety data
- tsca
- TSCA listed
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Pesticides used to destroy unwanted vegetation, especially various types of weeds, grasses (POACEAE), and woody plants. Some plants develop HERBICIDE RESISTANCE.
Pesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.
Chemicals used to destroy pests of any sort. The concept includes fungicides (FUNGICIDES, INDUSTRIAL); INSECTICIDES; RODENTICIDES; etc.
Uses & manufacturing
General Manufacturing InformationPhenol, 2-(1-methylpropyl)-4,6-dinitro-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1): INACTIVE
Applications
UsesHerbicide; insecticide; miticide.
Suppliers6 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海倍卓生物科技有限公司021-61119791,13386096464 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
深圳市丽晶生化科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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