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109-39-7

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Basic Information
CAS No.: 109-39-7
Name: 2-BUTOXYETHYL OLEATE
Article Data: 2
Molecular Structure:
Molecular Structure of 109-39-7 (2-BUTOXYETHYL OLEATE)
Formula: C24H46O3
Molecular Weight: 382.627
Synonyms: 9-Octadecenoicacid (Z)-, 2-butoxyethyl ester;Oleic acid, 2-butoxyethyl ester (7CI,8CI);Ethanol, 2-butoxy-, oleate (8CI);2-Butoxyethyl oleate;Butyl cellosolveoleate;Ethylene glycol monobutyl ether oleate;Hallco C 325;Kesscoflex BCO;Plasthall 325;S 817;2-Butoxyethyl (9Z)-octadec-9-enoate;9-octadecenoic acid, 2-butoxyethyl ester, (9Z)-;
EINECS: 203-669-9
Density: 0.893 g/cm3
Boiling Point: 462.5 °C at 760 mmHg
Flash Point: 168.5 °C
PSA: 35.53000
LogP: 7.38380
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Specification

The 9-Octadecenoic acid(9Z)-, 2-butoxyethyl ester, with the CAS registry number 109-39-7 and EINECS registry number 203-669-9, has the systematic name of 2-butoxyethyl (9Z)-octadec-9-enoate. It belongs to the following product categories: Plasticizers; Polymer Additives; Polymer Science. And the molecular formula of this chemical is C24H46O3.

The physical properties of 9-Octadecenoic acid(9Z)-, 2-butoxyethyl ester are as following: (1)ACD/LogP: 9.50; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.5; (4)ACD/LogD (pH 7.4): 9.5; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 3486195.5; (8)ACD/KOC (pH 7.4): 3486195.5; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 22; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.457; (14)Molar Refractivity: 116.81 cm3; (15)Molar Volume: 428.1 cm3; (16)Polarizability: 46.3×10-24cm3; (17)Surface Tension: 32 dyne/cm; (18)Density: 0.893 g/cm3; (19)Flash Point: 168.5 °C; (20)Enthalpy of Vaporization: 72.36 kJ/mol; (21)Boiling Point: 462.5 °C at 760 mmHg; (22)Vapour Pressure: 9.81E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCOCCCC)CCCCCCC\C=C/CCCCCCCC
(2)InChI: InChI=1/C24H46O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(25)27-23-22-26-21-6-4-2/h12-13H,3-11,14-23H2,1-2H3/b13-12-
(3)InChIKey: LBUOSVPOVIEPLJ-SEYXRHQNBW