Empirical Formula of 2,3,6-TBA-dimethylammonium [ISO] (CAS NO.3426-62-8): C9H10Cl3NO2
Molecular Weight: 270.5402
EINECS: 222-329-0
Flash Point: 150.1 °C
Enthalpy of Vaporization: 59.81 kJ/mol
Boiling Point: 324.5 °C at 760 mmHg
Vapour Pressure: 9.98E-05 mmHg at 25 °C
Structure of 2,3,6-TBA-dimethylammonium [ISO] (CAS NO.3426-62-8):
IUPAC Name: Dimethylazanium ; 2,3,6-Trichlorobenzoate
Canonical SMILES: C[NH2+]C.C1=CC(=C(C(=C1Cl)C(=O)[O-])Cl)Cl
InChI: InChI=1S/C7H3Cl3O2.C2H7N/c8-3-1-2-4(9)6(10)5(3)7(11)12;1-3-2/h1-2H,(H,11,12);3H,1-2H3
InChIKey: QSFRJEUITMJQCX-UHFFFAOYSA-N
1. | skn-gpg 500 mg open MOD DUPON* | |
2. | orl-rat LD50:1644 mg/kg DUPON* |
Moderately toxic by ingestion. A skin irritant. When heated to decomposition 2,3,6-TBA-dimethylammonium [ISO] (CAS NO.3426-62-8) emits very toxic fumes of Cl− and NOx.
2,3,6-TBA-dimethylammonium [ISO] , its cas register number is 3426-62-8. It also can be called 2,3,6-TBA-dimethylammonium ; 2,3,6-Trichlorobenzoic acid dimethylamine salt ; Kyselina 2,3,6-trichlorbenzoova dimethylamonna sul ; and Methanamine, N-methyl-, 2,3,6-trichlorobenzoate .
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