CAS No.1323-83-7,1,2-DISTEAROYL-RAC-GLYCEROL Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	1323-83-7
Name:	1,2-DISTEAROYL-RAC-GLYCEROL

Formula:	C₃₉H₇₆O₅
Molecular Weight:	625.02
Synonyms:	Stearin, di- (6CI,7CI,8CI);Diglyceryl stearate;Distearin;Distearoylglycerol;Emalex EGS-C;Estol 374GDS;Glycerol distearate;Kessco GDS 386F;Loxiol P 1200;Loxiol P 1206;Nikkol DGS 80;Precirol ATO;Stearic acid diglyceride;Stearic diglyceride;
EINECS:	256-941-4
Density:	0.923g/cm³
Melting Point:	72-74 °C
Boiling Point:	662.3°C at 760 mmHg
Flash Point:	181.8°C
Safety:	22-24/25
PSA:	72.83000
LogP:	11.95670

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Specification

The (2-hydroxy-3-octadecanoyloxypropyl) octadecanoate, with CAS registry number 1323-83-7, belongs to the following product categories: (1)Diacylglycerols; (2)Glycerides; (3)Neutral Glycerides. It has the systematic name of 3-hydroxypropane-1,2-diyl dioctadecanoate. This chemical should be stored at the temperature of −20°C. When use this chemical, do not breathe dust and avoid contact with skin and eyes. What's more, its EINECS is 256-941-4.

Physical properties of (2-hydroxy-3-octadecanoyloxypropyl) octadecanoate: (1)ACD/LogP: 16.47; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 16.47; (4)ACD/LogD (pH 7.4): 16.47; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 39; (12)Polar Surface Area: 61.83 Å²; (13)Index of Refraction: 1.466; (14)Molar Refractivity: 187.77 cm³; (15)Molar Volume: 677.1 cm³; (16)Polarizability: 74.43×10^-24cm³; (17)Surface Tension: 35 dyne/cm; (18)Density: 0.923 g/cm³; (19)Flash Point: 181.8 °C; (20)Enthalpy of Vaporization: 111.53 kJ/mol; (21)Boiling Point: 662.3 °C at 760 mmHg; (22)Vapour Pressure: 2.33E-20 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(COC(=O)CCCCCCCCCCCCCCCCC)CO)CCCCCCCCCCCCCCCCC
(2)InChI: InChI=1/C39H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40H,3-36H2,1-2H3
(3)InChIKey: UHUSDOQQWJGJQS-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C39H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37,40H,3-36H2,1-2H3
(5)Std. InChIKey: UHUSDOQQWJGJQS-UHFFFAOYSA-N