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5735-88-6

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Basic Information
CAS No.: 5735-88-6
Name: 2-undecyl-1,3-dioxolane
Article Data: 10
Molecular Structure:
Molecular Structure of 5735-88-6 (2-undecyl-1,3-dioxolane)
Formula: C14H28O2
Molecular Weight: 228.375
Synonyms: 2-Undecyl-1,3-dioxolane;2-Undecyldioxolane;Dodecanalcyclic ethylene acetal;Dodecanalethylene acetal;
Density: 0.888 g/cm3
Boiling Point: 280.2 °C at 760 mmHg
Flash Point: 112.2 °C
PSA: 18.46000
LogP: 4.28020
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Specification

The 1,3-Dioxolane,2-undecyl-, with the CAS registry number 5735-88-6, is also known as NSC48573. This chemical's molecular formula is C14H28O2 and molecular weight is 228.37. What's more, its systematic name is 2-Undecyl-1,3-dioxolane.

Physical properties of 1,3-Dioxolane,2-undecyl- are: (1)ACD/LogP: 5.08; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.442; (8)Molar Refractivity: 68.06 cm3; (9)Molar Volume: 256.9 cm3; (10)Polarizability: 26.98×10-24 cm3; (11)Surface Tension: 32 dyne/cm; (12)Density: 0.888 g/cm3; (13)Flash Point: 112.2 °C; (14)Enthalpy of Vaporization: 49.81 kJ/mol; (15)Boiling Point: 280.2 °C at 760 mmHg; (16)Vapour Pressure: 0.00651 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCC1OCCO1
(2)InChI: InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14/h14H,2-13H2,1H3
(3)InChIKey: BKFFGALSQITQAW-UHFFFAOYSA-N