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144128-70-1

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Basic Information
CAS No.: 144128-70-1
Name: 5-[4-(DIMETHYLAMINO)PHENYL]-1,3-CYCLOHEXANEDIONE
Molecular Structure:
Molecular Structure of 144128-70-1 (5-[4-(DIMETHYLAMINO)PHENYL]-1,3-CYCLOHEXANEDIONE)
Formula: C14H17NO2
Molecular Weight: 231.29
Synonyms: 5-[4-(Dimethylamino)phenyl]-1,3-cyclohexanedione;
Density: 1.147 g/cm3
Melting Point: 191-196 °C(lit.)
Boiling Point: 415.3 °C at 760 mmHg
Flash Point: 190.9 °C
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 37.38000
LogP: 2.15830
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  • 5-[4-(Dimethylamino)phenyl]cyclohexane-1,3-dione

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Specification

The 1,3-Cyclohexanedione,5-[4-(dimethylamino)phenyl]-, with the CAS registry number 144128-70-1, is also known as 5-[4-(Dimethylamino)phenyl]-1,3-cyclohexanedione. It belongs to the product categories of Miscellaneous; C13 to C14; Carbonyl Compounds; Ketones. This chemical's molecular formula is C14H17NO2 and molecular weight is 231.2903. Its systematic name is called 5-[4-(dimethylamino)phenyl]cyclohexane-1,3-dione.

Physical properties of 1,3-Cyclohexanedione,5-[4-(dimethylamino)phenyl]-: (1)ACD/LogP: 1.09; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.575; (5)Molar Refractivity: 66.68 cm3; (6)Molar Volume: 201.6 cm3; (7)Surface Tension: 46.8 dyne/cm; (8)Density: 1.147 g/cm3; (9)Flash Point: 190.9 °C; (10)Enthalpy of Vaporization: 66.83 kJ/mol; (11)Boiling Point: 415.3 °C at 760 mmHg; (12)Vapour Pressure: 4.18E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2CC(c1ccc(N(C)C)cc1)CC(=O)C2
(2)InChI: InChI=1/C14H17NO2/c1-15(2)12-5-3-10(4-6-12)11-7-13(16)9-14(17)8-11/h3-6,11H,7-9H2,1-2H3
(3)InChIKey: WANNTJAQMZXABU-UHFFFAOYAY