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| Name |
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride |
EINECS | N/A |
| CAS No. | 77966-32-6 | Density | N/A |
| PSA | 20.31000 | LogP | 2.26540 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C20H25 Cl N2 O . Cl H | Boiling Point | 479.8°C at 760 mmHg |
| Molecular Weight | 381.38 | Flash Point | 244°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal and subcutaneous routes. An eye irritant. When heated to decomposition it emits very toxic fumes of NOx, HCl, and Cl−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Acetamide,N-(2-chloro-6-methylphenyl)-2-(diethylamino)-N-(phenylmethyl)-,monohydrochloride (9CI) |
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride Chemical Properties
Molecule structure of N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride (CAS NO.77966-32-6):
IUPAC Name: [2-(N-Benzyl-2-chloro-6-methylanilino)-2-oxoethyl]-diethylazanium chloride
Molecular Weight: 381.33924 g/mol
Molecular Formula: C20H26Cl2N2O
Boiling Point: 479.8 °C at 760 mmHg
Flash Point: 244 °C
Enthalpy of Vaporization: 74.41 kJ/mol
Vapour Pressure: 2.3E-09 mmHg at 25 °C
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 7
Exact Mass: 380.142219
MonoIsotopic Mass: 380.142219
Topological Polar Surface Area: 24.8
Heavy Atom Count: 25
Complexity: 380
Canonical SMILES: CC[NH+](CC)CC(=O)N(CC1=CC=CC=C1)C2=C(C=CC=C2Cl)C.[Cl-]
InChI: InChI=1S/C20H25ClN2O.ClH/c1-4-22(5-2)15-19(24)23(14-17-11-7-6-8-12-17)20-16(3)10-9-13-18(20)21;/h6-13H,4-5,14-15H2,1-3H3;1H
InChIKey: NSIQUHOMQRHFNU-UHFFFAOYSA-N
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride Toxicity Data With Reference
| 1. | eye-rbt 2% MOD | ARZNAD Arzneimittel-Forschung. Drug Research. 8 (1958),609. | ||
| 2. | ipr-rat LD50:96 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 8 (1958),609. | ||
| 3. | scu-mus LD50:360 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 8 (1958),609. |
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride Safety Profile
Poison by intraperitoneal and subcutaneous routes. An eye irritant. When heated to decomposition it emits very toxic fumes of NOx, HCl, and Cl−.
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride Specification
N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride (CAS NO.77966-32-6) is also named as C 3136 ; o-Acetotoluidide, N-benzyl-6'-chloro-2-(diethylamino)-, hydrochloride . N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride (CAS NO.77966-32-6) is highly toxic. It is flammable. It will produce toxic nitrogen oxide, chlorine and hydrogen chloride fumes when buring. So the storage environment should be ventilate, low-temperature and dry. Keep N-Benzyl-6'-chloro-2-(diethylamino)-o-acetotoluidide hydrochloride (CAS NO.77966-32-6) separate from raw materials of food.
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