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Name |
Piperidine,1-(2,2-diethoxyethyl)- |
EINECS | 222-802-1 |
CAS No. | 3616-58-8 | Density | 0.939 g/cm3 |
PSA | 21.70000 | LogP | 1.80930 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H23NO2 | Boiling Point | 220 °C at 760 mmHg |
Molecular Weight | 201.309 | Flash Point | 64 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
1-Piperidineacetaldehyde,diethyl acetal (6CI,7CI,8CI);NSC 66158; |
Article Data | 7 |
The Piperidine,1-(2,2-diethoxyethyl)- is an organic compound with the formula C11H23NO2. The IUPAC name of this chemical is 1-(2,2-diethoxyethyl)piperidine. With the CAS registry number 3616-58-8, it is also named as 1-Piperidineacetaldehyde diethyl acetal. Besides, it should be stored in a closed cool and dry place.
Physical properties about Piperidine,1-(2,2-diethoxyethyl)- are: (1)ACD/LogP: 2.34; (2)ACD/LogD (pH 5.5): -0.71; (3)ACD/LogD (pH 7.4): 0.27; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 3.79; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 21.7 Å2; (11)Index of Refraction: 1.453; (12)Molar Refractivity: 57.93 cm3; (13)Molar Volume: 214.2 cm3; (14)Polarizability: 22.96×10-24cm3; (15)Surface Tension: 31.1 dyne/cm; (16)Density: 0.939 g/cm3; (17)Flash Point: 64 °C; (18)Enthalpy of Vaporization: 45.64 kJ/mol; (19)Boiling Point: 220 °C at 760 mmHg; (20)Vapour Pressure: 0.116 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O(C(OCC)CN1CCCCC1)CC
(2)InChI: InChI=1/C11H23NO2/c1-3-13-11(14-4-2)10-12-8-6-5-7-9-12/h11H,3-10H2,1-2H3
(3)InChIKey: VSHHRRNJQBETGT-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C11H23NO2/c1-3-13-11(14-4-2)10-12-8-6-5-7-9-12/h11H,3-10H2,1-2H3
(5)Std. InChIKey: VSHHRRNJQBETGT-UHFFFAOYSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 75mg/kg (75mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07816, |