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84788-08-9

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Basic Information
CAS No.: 84788-08-9
Name: propyl 2,4-decadienoate
Article Data: 2
Molecular Structure:
Molecular Structure of 84788-08-9 (propyl 2,4-decadienoate)
Formula: C13H22O2
Molecular Weight: 210.316
Synonyms: Propyl2,4-decadienoate;
EINECS: 284-147-8
Density: 0.899 g/cm3
Boiling Point: 282.8 °C at 760 mmHg
Flash Point: 128.3 °C
Solubility: Soluble in fat; Insoluble in water
Appearance: colourless to light pale yellow liquid
PSA: 26.30000
LogP: 3.63230
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  • 2,4-Decadienoic acid,propyl ester CAS 84788-08-9

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Specification

The CAS registry number of 2,4-Decadienoic acid,propyl ester is 84788-08-9. Its EINECS registry number is 284-147-8. This chemical's molecular formula is C13H22O2 and molecular weight is 210.3126. Its systematic name is called propyl deca-2,4-dienoate.

Physical properties of 2,4-Decadienoic acid,propyl ester: (1)ACD/LogP:5.05; (2)# of Rule of 5 Violations:1; (3)ACD/LogD (pH 5.5):5.05; (4)ACD/LogD (pH 7.4):5.05; (5)#H bond acceptors:2; (6)#Freely Rotating Bonds:9; (7)Index of Refraction:1.461; (8)Molar Refractivity:64.16 cm3; (9)Molar Volume:233.8 cm3; (10)Surface Tension:30.2 dyne/cm; (11)Density:0.899 g/cm3; (12)Flash Point:128.3 °C; (13)Enthalpy of Vaporization:52.17 kJ/mol; (14)Boiling Point:282.8 °C at 760 mmHg; (15)Vapour Pressure:0.00328 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCOC(=O)C=CC=CCCCCC
(2)InChI: InChI=1/C13H22O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h8-11H,3-7,12H2,1-2H3
(3)InChIKey: RKDOXCGYGLYOBV-UHFFFAOYAD