2,3,6-TBA-dimethylammonium
Basic information
- CAS
3426-62-8- Standard SMILES
C[NH2+]C.O=C([O-])c1c(Cl)ccc(Cl)c1Cl- InChIKey
QSFRJEUITMJQCX-UHFFFAOYSA-N- Molecular formula
- C9H10Cl3NO2
- Average molar mass
- 270.5 g/mol
- Monoisotopic mass
- 268.977712
Names & identifiers
- Preferred name
- 2,3,6-TBA-dimethylammonium
- IUPAC
- dimethylazanium;2,3,6-trichlorobenzoate
- English name
- 2,3,6-Trichlorobenzoic acid dimethylamine salt
- Molecular formula
- C9H10Cl3NO2
- Molecular weight
- 270.54
Names & synonyms
PolidimBenzac 12813426-62-82,3,6-TBA-dimethylammoniumTrysben 200Methanamine, N-methyl-, 2,3,6-trichlorobenzoateSE880I159JRefChem:1059253222-329-02,3,6-Trichlorobenzoic acid dimethylamine saltdimethylazanium;2,3,6-trichlorobenzoate2,3,6-TBA-dimethylammonium [ISO]
Show more names
kf2dimethylazanium2,3,6-trichlorobenzoate2,3,6-tba,dimethylaminesaltDIMETHYLAMINE 2,3,6-TRICHLOROBENZOATEtrichlorobenzoicaciddimethylaminesaltmethanamine,n-methyl-,2,3,6-trichlorobenzoate
Dimethylamine, 2,3,6-trichlorobenzoateKF 2 (Herbicide)Caswell No. 8732KFEINECS 222-329-0EPA Pesticide Chemical Code 017303UNII-SE880I159J2,3,6-Trichlorobenzoic acid, dimethylamine salt
Database identifiers
- CAS
3426-62-8- PubChem CID
- 18905
- DTXSID
DTXSID3074999- EC Number
- 222-329-0
Properties
Computed structural properties
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- FDA UNII
- 880 I159J · SE880I159J
- EPA Substance Registry System
- 2 · 2,3,6-Trichlorobenzoic acid dimethylamine salt (3426-62-8)
- RTECS
- 8400000 · DH8400000
- Toxicity
- 50 oral · LD50 oral in rat: 1644mg/kg
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- rtecs
- DH8400000
- Toxicity
- LD50 oral in rat: 1644mg/kg
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Related reactions
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Compound notes
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