Monocaprylin supplier | CasNO.26402-26-6

Name
Monocaprylin
EINECS 247-668-1
CAS No. 26402-26-6
Density 1.044 g/cm³
Solubility 330g/L at 20℃
Melting Point 39.0 to 43.0 °C
Formula C₁₁H₂₂O₄
Boiling Point 340 °C at 760 mmHg
Molecular Weight 218.29
Flash Point 123.4 °C
Transport Information
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Hazard Symbols
Synonyms octanoic acid, monoester with glycerol;Imwitor 308;Sunsoft 700p2;Octanoic acid,esters,monoester with 1,2,3-propanetriol;Poem M 100;Sefsol 318;
PSA 66.76000
LogP 1.24330

Monocaprylin Specification

The Monocaprylin is an organic compound with the formula C₁₁H₂₂O₄. The IUPAC name of this chemical is 2,3-dihydroxypropyl octanoate. With the CAS registry number 26402-26-6, it is also named as Glyceryl caprylate.

Physical properties about Monocaprylin are: (1)ACD/LogP: 1.92; (2)ACD/LogD (pH 5.5): 1.91; (3)ACD/LogD (pH 7.4): 1.91; (4)ACD/BCF (pH 5.5): 16.8; (5)ACD/BCF (pH 7.4): 16.8; (6)ACD/KOC (pH 5.5): 262.2; (7)ACD/KOC (pH 7.4): 262.2; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 12; (11)Polar Surface Area: 44.76 Å²; (12)Index of Refraction: 1.465; (13)Molar Refractivity: 57.81 cm³; (14)Molar Volume: 208.9 cm³; (15)Polarizability: 22.91×10^-24cm³; (16)Surface Tension: 39.9 dyne/cm; (17)Density: 1.044 g/cm³; (18)Flash Point: 123.4 °C; (19)Enthalpy of Vaporization: 67.59 kJ/mol; (20)Boiling Point: 340 °C at 760 mmHg; (21)Vapour Pressure: 5.91E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(O)CO)CCCCCCC
(2)InChI: InChI=1/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
(3)InChIKey: GHBFNMLVSPCDGN-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
(5)Std. InChIKey: GHBFNMLVSPCDGN-UHFFFAOYSA-N

Product Name

Monocaprylin

Monocaprylin Specification

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