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1323-38-2

Basic Information
CAS No.: 1323-38-2
Name: Glyceryl monoricinoleate
Molecular Structure:
Molecular Structure of 1323-38-2 (Glyceryl monoricinoleate)
Formula: C21H40O5
Molecular Weight: 372.54
Synonyms: Loxiol G 11;9-Octadecenoic acid,12-hydroxy-,(9Z,12R)-,monoester with 1,2,3-propanetriol;Aldo MR;Rilanit GMRO;
EINECS: 215-353-8
Density: 1.019 g/cm3
Boiling Point: 520.5 °C at 760 mmHg
Flash Point: 169.8 °C
Solubility: Insoluble in water,Soluble in solvents
Appearance: Viscous liquid
PSA: 86.99000
LogP: 3.89110
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Specification

The Glyceryl monoricinoleate, with CAS registry number 1323-38-2, has the systematic name of 2,3-dihydroxypropyl 12-hydroxyoctadec-9-enoate. Besides this, it is also called 9-octadecenoic acid, 12-hydroxy-, 2,3-dihydroxypropyl ester. And the chemical formula of this chemical is C21H40O5. What's more, its EINECS is 215-353-8.

Physical properties of Glyceryl monoricinoleate: (1)ACD/LogP: 4.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.71; (4)ACD/LogD (pH 7.4): 4.71; (5)ACD/BCF (pH 5.5): 2247.93; (6)ACD/BCF (pH 7.4): 2247.93; (7)ACD/KOC (pH 5.5): 8725.75; (8)ACD/KOC (pH 7.4): 8725.74; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 22; (12)Polar Surface Area: 53.99 Å2; (13)Index of Refraction: 1.49; (14)Molar Refractivity: 105.69 cm3; (15)Molar Volume: 365.5 cm3; (16)Polarizability: 41.9×10-24cm3; (17)Surface Tension: 40.9 dyne/cm; (18)Density: 1.019 g/cm3; (19)Flash Point: 169.8 °C; (20)Enthalpy of Vaporization: 91.32 kJ/mol; (21)Boiling Point: 520.5 °C at 760 mmHg; (22)Vapour Pressure: 5.19E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(O)CO)CCCCCCCC=CCC(O)CCCCCC
(2)InChI: InChI=1/C21H40O5/c1-2-3-4-11-14-19(23)15-12-9-7-5-6-8-10-13-16-21(25)26-18-20(24)17-22/h9,12,19-20,22-24H,2-8,10-11,13-18H2,1H3
(3)InChIKey: HDIFHQMREAYYJW-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C21H40O5/c1-2-3-4-11-14-19(23)15-12-9-7-5-6-8-10-13-16-21(25)26-18-20(24)17-22/h9,12,19-20,22-24H,2-8,10-11,13-18H2,1H3
(5)Std. InChIKey: HDIFHQMREAYYJW-UHFFFAOYSA-N