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CAS No.: | 10595-72-9 |
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Name: | DITRIDECYL 3,3'-THIODIPROPIONATE |
Molecular Structure: | |
Formula: | C32H62O4S |
Molecular Weight: | 542.90 |
Synonyms: | Propanoicacid, 3,3'-thiobis-, ditridecyl ester (9CI);Propionic acid, 3,3'-thiodi-,ditridecyl ester (7CI,8CI);1-Tridecanol, 3,3'-thiodipropionate (8CI);ADK StabAO 503;ADK Stab AO 503A;Antioxidant 711;Bis(tridecyl) 3,3'-thiodipropionate;Bis(tridecyl) thiodipropionate;Cyanox 711;Ditridecyl 3,3'-thiodipropionate;Evanstab 13;Mark AO 503;Mark AO 503A;Plastanox 711;Sumilizer TL; |
EINECS: | 234-206-9 |
Density: | 0.94 g/cm3 |
Boiling Point: | 602.741 °C at 760 mmHg |
Flash Point: | 275.203 °C |
Appearance: | Colorless or Light Yellow transparent Liquid |
PSA: | 77.90000 |
LogP: | 10.20820 |
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Ditridecyl 3,3'-thiodipropionate is an organic compound with the formula C32H62O4S, and its systematic name is the same with the product name. With the CAS registry number 10595-72-9, it is also named as Propionic acid, 3,3'-thiodi-, ditridecyl ester. It belongs to the product categories of Polymer Additives; Polymer Science; Stabilizers. Its EINECS number is 234-206-9. In addition, the molecular weight is 542.90. This chemical should be sealed and stored in a cool, ventilated and dry place. Moreover, it should be ensured that the workshop is well ventilated or equipped with exhaust devices.
Physical properties of Ditridecyl 3,3'-thiodipropionate are: (1)ACD/LogP: 12.935 # of Rule of 5 Violations: 2; (2)ACD/LogD (pH 5.5): 12.94; (3)ACD/LogD (pH 7.4): 12.94; (4)ACD/BCF (pH 5.5): 1000000.00; (5)ACD/BCF (pH 7.4): 1000000.00; (6)ACD/KOC (pH 5.5): 10000000.00; (7)ACD/KOC (pH 7.4): 10000000.00; (8)#H bond acceptors: 4; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 32; (11)Polar Surface Area: 77.9 Å2; (12)Index of Refraction: 1.472; (13)Molar Refractivity: 161.847 cm3; (14)Molar Volume: 577.685 cm3; (15)Polarizability: 64.161×10-24cm3; (16)Surface Tension: 35.03 dyne/cm; (17)Density: 0.94 g/cm3; (18)Flash Point: 275.203 °C; (19)Enthalpy of Vaporization: 89.667 kJ/mol; (20)Boiling Point: 602.741 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCCCCCCCCCCCC)CCSCCC(=O)OCCCCCCCCCCCCC
(2)Std. InChI: InChI=1S/C32H62O4S/c1-3-5-7-9-11-13-15-17-19-21-23-27-35-31(33)25-29-37-30-26-32(34)36-28-24-22-20-18-16-14-12-10-8-6-4-2/h3-30H2,1-2H3
(3)Std. InChIKey: MZHULIWXRDLGRR-UHFFFAOYSA-N