Propanal,3-(diethylamino)-2,2-dimethyl- supplier

Name
3-DIETHYLAMINO-2,2-DIMETHYL-PROPIONALDEHYDE
EINECS
CAS No. 6343-47-1
Article Data9
CAS DataBase
Density 0.865 g/cm³
Solubility
Melting Point
Formula C₉H₁₉NO
Boiling Point 196.3 °C at 760 mmHg
Molecular Weight 157.256
Flash Point 49.6 °C
Transport Information
Appearance
Safety 26
Risk Codes 36
Molecular Structure
Hazard Symbols Xi
Synonyms alpha-Dimethyl-beta-diethylaminopropionaldehyde;3-(Diethylamino)-2,2-dimethylpropionaldehyde;Propionaldehyde, 3-(diethylamino)-2,2-dimethyl-;
PSA 20.31000
LogP 1.55330

Propanal,3-(diethylamino)-2,2-dimethyl- Specification

The Propanal,3-(diethylamino)-2,2-dimethyl-, with the CAS registry number 6343-47-1, is also known as alpha-Dimethyl-beta-diethylaminopropionaldehyde. This chemical's molecular formula is C₉H₁₉NO and molecular weight is 157.25. What's more, its IUPAC name is 3-(diethylamino)-2,2-dimethylpropanal. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes.

Physical properties of Propanal,3-(diethylamino)-2,2-dimethyl- are: (1)ACD/LogP: 1.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.3; (4)ACD/LogD (pH 7.4): -0.4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.49; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.437; (14)Molar Refractivity: 47.61 cm³; (15)Molar Volume: 181.7 cm³; (16)Polarizability: 18.87×10^-24cm³; (17)Surface Tension: 28.5 dyne/cm; (18)Density: 0.865 g/cm³; (19)Flash Point: 49.6 °C; (20)Enthalpy of Vaporization: 43.25 kJ/mol; (21)Boiling Point: 196.3 °C at 760 mmHg; (22)Vapour Pressure: 0.401 mmHg at 25°C.

Preparation: this chemical can be prepared by diethylamine, isobutyraldehyde and dibromomethane at the temperature of 20-55°C. This reaction will need solvent CH₂Cl₂ with the reaction time of 1.6 hours. The yield is about 65%.

Propanal,3-(diethylamino)-2,2-dimethyl- can be prepared by diethylamine, isobutyraldehyde and dibromomethane at the temperature of 20-55°C

You can still convert the following datas into molecular structure:
(1)SMILES: O=CC(C)(C)CN(CC)CC
(2)Std. InChI: InChI=1S/C9H19NO/c1-5-10(6-2)7-9(3,4)8-11/h8H,5-7H2,1-4H3
(3)Std. InChIKey: AAHIYAKUVPMLMX-UHFFFAOYSA-N

Product Name

3-DIETHYLAMINO-2,2-DIMETHYL-PROPIONALDEHYDE

Propanal,3-(diethylamino)-2,2-dimethyl- Specification

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