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9-Octadecenoic acid(9Z)-, 1,1'-anhydride

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Name

9-Octadecenoic acid(9Z)-, 1,1'-anhydride

EINECS 246-522-4
CAS No. 24909-72-6 Density 0.895 g/cm3
PSA 43.37000 LogP 12.13120
Solubility N/A Melting Point 22-24 °C(lit.)
Formula C36H66O3 Boiling Point 609.4 °C at 760 mmHg
Molecular Weight 546.918 Flash Point 275.4 °C
Transport Information N/A Appearance clear yellow to orange oily liquid
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 24909-72-6 (OLEIC ANHYDRIDE) Hazard Symbols IrritantXi
Synonyms

9-Octadecenoicacid (9Z)-, anhydride (9CI);9-Octadecenoic acid (Z)-, anhydride;Oleicanhydride (6CI,7CI);Oleic acid anhydride;Oleoyl anhydride;(9Z)-Octadec-9-enoic anhydride;Oleic Anhydride;

Article Data 9

9-Octadecenoic acid(9Z)-, 1,1'-anhydride Specification

The 9-Octadecenoic acid(9Z)-, 1,1'-anhydride, with the CAS registry number 24909-72-6 and EINECS registry number 246-522-4, has the systematic name (9Z)-octadec-9-enoic anhydride. And the molecular formula of this chemical is C36H66O3. In addition, it is a kind of clear yellow to orange oily liquid, and should be stored at -20°C.

The physical properties of 9-Octadecenoic acid(9Z)-, 1,1'-anhydride are as following: (1)ACD/LogP: 15.48; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 32; (6)Polar Surface Area: 43.37 Å2; (7)Index of Refraction: 1.471; (8)Molar Refractivity: 170.75 cm3; (9)Molar Volume: 610.6 cm3; (10)Polarizability: 67.69×10-24cm3; (11)Surface Tension: 33.4 dyne/cm; (12)Density: 0.895 g/cm3; (13)Flash Point: 275.4 °C; (14)Enthalpy of Vaporization: 90.52 kJ/mol; (15)Boiling Point: 609.4 °C at 760 mmHg; (16)Vapour Pressure: 8.57E-15 mmHg at 25°C.

Preparation of 9-Octadecenoic acid(9Z)-, 1,1'-anhydride: It can be prepared by octadec-9-enoic acid. This reaction will need reagents 2-chloro-1,3-dimethylimidazolinium chloride and Et3N, and the solvent CH2Cl2. The reaction time is 43 hours with temperature of 20°C, and the yield is about 57%.

9-Octadecenoic acid(9Z)-, 1,1'-anhydride can be prepared by octadec-9-enoic acid

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting 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(OC(=O)CCCCCCC\C=C/CCCCCCCC)CCCCCCC\C=C/CCCCCCCC
(2)InChI: InChI=1/C36H66O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(37)39-36(38)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-34H2,1-2H3/b19-17-,20-18-
(3)InChIKey: OCNZHGHKKQOQCZ-CLFAGFIQBM

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