-
Name
1-(2-{[1-(2,4-dimethylphenoxy)propan-2-yl](ethyl)amino}-2-oxoethyl)piperidinium chloride
- EINECS
- CAS No. 77791-38-9
- Density g/cm3
- Solubility
- Melting Point
- Formula C20H32N2O2•ClH
- Boiling Point 464.7°Cat760mmHg
- Molecular Weight 369.00
- Flash Point 234.8°C
- Transport Information
- Appearance
- Safety Poison by subcutaneous route. An eye irritant. When heated to decomposition it emits very toxic fumes of NOx and HCl.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride Chemical Properties
IUPAC Name: N-[1-(2,4-dimethylphenoxy)propan-2-yl]-N-ethyl-2-piperidin-1-ium-1-ylacetamide
chloride
Empirical Formula: C20H33ClN2O2
Molecular Weight: 368.9412g/mol
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 7
Exact Mass: 368.223056
MonoIsotopic Mass: 368.223056
Topological Polar Surface Area: 34
Heavy Atom Count: 25
Formal Charge: 0
Complexity: 382
Flash Point: 234.8 °C
Enthalpy of Vaporization: 72.61 kJ/mol
Boiling Point: 464.7 °C at 760 mmHg
Vapour Pressure: 8.19E-09 mmHg at 25°C
Canonical SMILES: CCN(C(C)COC1=C(C=C(C=C1)C)C)C(=O)C[NH+]2CCCCC2.[Cl-]
InChI: InChI=1S/C20H32N2O2.ClH/c1-5-22(20(23)14-21-11-7-6-8-12-21)18(4)15-24-
19-10-9-16(2)13-17(19)3;/h9-10,13,18H,5-8,11-12,14-15H2,1-4H3;1H
InChIKey: FZDSKKRGMHFGCF-UHFFFAOYSA-N
Structure of N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride (CAS NO.77791-38-9):
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N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride Toxicity Data With Reference
| 1. | eye-rbt 2% MLD | ARZNAD Arzneimittel-Forschung. Drug Research. 9 (1959),70. | ||
| 2. | scu-mus LD50:157 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 9 (1959),70. |
N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride Safety Profile
Poison by subcutaneous route. An eye irritant. When heated to decomposition it emits very toxic fumes of NOx and HCl.
N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride Specification
N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride , its cas register number is 77791-38-9. It also can be called C 2102 ; Acetamide, N-ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)-, hydrochloride . N-Ethyl-2-(piperidino)-N-(1-(2,4-xylyloxy)-2-propyl)acetamide hydrochloride (CAS NO.77791-38-9) will cause an eye irritant. When heated to decomposition it emits very toxic fumes of NOx and HCl.
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