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7459-33-8

Basic Information
CAS No.: 7459-33-8
Name: LINOLEOYL CHLORIDE
Article Data: 63
Molecular Structure:
Molecular Structure of 7459-33-8 (LINOLEOYL CHLORIDE)
Formula: C18H31ClO
Molecular Weight: 298.897
Synonyms: 9,12-Octadecadienoylchloride, (Z,Z)-;Linoleoyl chloride (6CI,7CI,8CI);(Z,Z)-Octadeca-9,12-dienoylchloride;Linoleic acid chloride;(9Z,12Z)-Octadeca-9,12-dienoyl chloride;
EINECS: 231-233-8
Density: 0.93 g/cm3
Boiling Point: 380.804 °C at 760 mmHg
Flash Point: 183.658 °C
Appearance: dark brown liquid or oil
Hazard Symbols: CorrosiveC
Risk Codes: 34
Safety: 28A-26-45-36/37/39-27
PSA: 17.07000
LogP: 6.56530
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Specification

The 9,12-Octadecadienoylchloride, (9Z,12Z)-, with the CAS registry number 7459-33-8, has the systematic name of 2,2',4,4',5,5'-hexabromobiphenyl. And the molecular formula of this chemical is C18H31ClO. It is a kind of dark brown liquid or oil, and belongs to the following product categories: Acid Chlorides Unsaturated fatty acids and derivatives; Omega 6 fatty acids and derivatives; Polyunsaturated; Unsaturated fatty acids and derivatives. What's more, it should be stored in the refrigerator.

The physical properties of 9,12-Octadecadienoylchloride, (9Z,12Z)- are as following: (1)ACD/LogP: 7.59; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8; (4)ACD/LogD (pH 7.4): 8; (5)ACD/BCF (pH 5.5): 617922; (6)ACD/BCF (pH 7.4): 617922; (7)ACD/KOC (pH 5.5): 486095; (8)ACD/KOC (pH 7.4): 486095; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 90.435 cm3; (15)Molar Volume: 321.391 cm3; (16)Polarizability: 35.851×10-24cm3; (17)Surface Tension: 32.303 dyne/cm; (18)Density: 0.93 g/cm3; (19)Flash Point: 183.658 °C; (20)Enthalpy of Vaporization: 62.9 kJ/mol; (21)Boiling Point: 380.804 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You should be cautious while dealing with this chemical. It may cause burns. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; Take off immediately all contaminated clothing; After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer); In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(=O)CCCCCCC\C=C/C\C=C/CCCCC
(2)InChI: InChI=1/C18H31ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3/b7-6-,10-9-
(3)InChIKey: FBWMYSQUTZRHAT-HZJYTTRNBC