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| Name |
Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride |
EINECS | N/A |
| CAS No. | 63906-42-3 | Density | g/cm3 |
| PSA | 38.77000 | LogP | 3.12540 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C16H19 N O3 . Cl H | Boiling Point | 408.7°Cat760mmHg |
| Molecular Weight | 309.793 | Flash Point | 201°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and HCl. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Aceticacid, (1-naphthalenyloxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (9CI);Acetic acid, (1-naphthyloxy)-, 2-(dimethylamino)ethyl ester, hydrochloride(7CI) |
Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride Chemical Properties
Molecular Formula: C16H20ClNO3
Molecular Weight: 309.787900 g/mol
The Molecular Structure of Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride (CAS NO.63906-42-3):
IUPAC: dimethyl-[2-(2-naphthalen-1-yloxyacetyl)oxyethyl]azanium chloride
Flash Point: 201 °C
Enthalpy of Vaporization: 66.08 kJ/mol
Boiling Point: 408.7 °C at 760 mmHg
Vapour Pressure: 6.87E-07 mmHg at 25°C
Nominal Mass: 309 Da
Average Mass: 309.7879 Da
Monoisotopic Mass: 309.113171 Da
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 0.26
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 5.5): 1
ACD/BCF (pH 7.4): 11.3
ACD/KOC (pH 5.5): 2.29
ACD/KOC (pH 7.4): 113.96
Polar Surface Area: 35.53Å2
InChI: InChI=1/C16H19NO3.ClH/c1-17(2)10-11-19-16(18)12-20-15-9-5-7-13-6-3-4-8-14(13)15;/h3-9H,10-12H2,1-2H3;1H
Smiles: c12c(cccc1cccc2)OCC(OCC[NH+](C)C)=O.[ClH-]
Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride (CAS NO.63906-42-3) is also called as 2-Dimethylaminoethyl 1-naphthyloxyacetate hydrochloride .
Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride Toxicity Data With Reference
| 1. | ivn-mus LD50:160 mg/kg | CRSBAW Comptes Rendus des Seances de la Societe de Biologie et de Ses Filiales. 153 (1959),1914. |
Acetic acid, 1-naphthyloxy-, 2-dimethylaminoethyl ester, hydrochloride Safety Profile
A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx and HCl.
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