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13-Octadecenal, (13Z)-

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Name

13-Octadecenal, (13Z)-

EINECS 261-349-4
CAS No. 58594-45-9 Density 0.841 g/cm3
Solubility Insoluble in water Melting Point
Formula C18H34O Boiling Point 356 °C at 760 mmHg
Molecular Weight 266.462 Flash Point 179.2 °C
Transport Information UN1993 Appearance colorless to yellow liquid
Safety Risk Codes
Molecular Structure Molecular Structure of 58594-45-9 (13-Octadecenal, (13Z)-) Hazard Symbols
Synonyms

cis-13-Octadecenal;(Z)-13-Octadecenal;13-Octadecenal,(Z)-;

 

13-Octadecenal, (13Z)- Specification

The 13-Octadecenal, (13Z)-, with the CAS registry number 58594-45-9, is also known as 13-Octadecenal, (Z)-. Its EINECS registry number is 261-349-4. This chemical's molecular formula is C18H34O and molecular weight is 266.46. Its IUPAC name is called (Z)-octadec-13-enal.

Physical properties of 13-Octadecenal, (13Z)-: (1)ACD/LogP: 7.83; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 1; (4)#Freely Rotating Bonds: 15; (5)Index of Refraction: 1.453; (6)Molar Refractivity: 85.68 cm3; (7)Molar Volume: 316.5 cm3; (8)Surface Tension: 30.5 dyne/cm; (9)Density: 0.841 g/cm3; (10)Flash Point: 179.2 °C; (11)Enthalpy of Vaporization: 60.12 kJ/mol; (12)Boiling Point: 356 °C at 760 mmHg; (13)Vapour Pressure: 3E-05 mmHg at 25°C.

Preparation of 13-Octadecenal, (13Z)-: this chemical can be prepared by octadec-13c-en-1-ol. This reaction will need reagent Py•HClCrO3.

13-Octadecenal, (13Z)- can be prepared by octadec-13c-en-1-ol

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCC=CCCCCCCCCCCCC=O
(2)Isomeric SMILES: CCCC/C=C\CCCCCCCCCCCC=O
(3)InChI: InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h5-6,18H,2-4,7-17H2,1H3/b6-5-
(4)InChIKey: QIRGIHPYVVKWTO-WAYWQWQTSA-N

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