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CAS No.: | 13162-46-4 |
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Name: | trans,trans-2,4-undecadienal |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C11H18O |
Molecular Weight: | 166.263 |
Synonyms: | (2E,4E)-2,4-Undecadienal;(E,E)-2,4-Undecadien-1-al;2,4-undecadienal, (2E,4E)-;trans,trans-2,4-Undecadien-1-al;2,4-Undecadienal, (E,E)-;Undeca-2,4-dien-1-al; |
EINECS: | 250-148-7 |
Density: | 0.854 g/cm3 |
Boiling Point: | 256.4 °C at 760 mmHg |
Flash Point: | 111.1 °C |
Solubility: | Insoluble in water; soluble in alcohol. |
Appearance: | yellow liquid |
PSA: | 17.07000 |
LogP: | 3.26810 |
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The 2,4-Undecadienal, with CAS registry number 13162-46-4, belongs to the following product category: Aldehyde Flavor. Its systematic name and its IUPAC name are the same, which is (2E,4E)-undeca-2,4-dienal. Besides this, it is also called trans,trans-2,4-Undecadien-1-al. And the chemical formula of this chemical is C11H18O.
Physical properties of 2,4-Undecadienal: (1)ACD/LogP: 3.71; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 17.07 Å2; (7)Index of Refraction: 1.459; (8)Molar Refractivity: 53.31 cm3; (9)Molar Volume: 194.6 cm3; (10)Polarizability: 21.13×10-24cm3; (11)Surface Tension: 29.3 dyne/cm; (12)Enthalpy of Vaporization: 49.39 kJ/mol; (13)Vapour Pressure: 0.0154 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C\C=C\C=C\CCCCCC
(2)InChI: InChI=1/C11H18O/c1-2-3-4-5-6-7-8-9-10-11-12/h7-11H,2-6H2,1H3/b8-7+,10-9+
(3)InChIKey: UVIUIIFPIWRILL-XBLVEGMJBB
(4)Std. InChI: InChI=1S/C11H18O/c1-2-3-4-5-6-7-8-9-10-11-12/h7-11H,2-6H2,1H3/b8-7+,10-9+
(5)Std. InChIKey: UVIUIIFPIWRILL-XBLVEGMJSA-N