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n-Butyryl tri-n-hexyl citrate (82469-79-2)

Identification
Name:n-Butyryl tri-n-hexyl citrate
Synonyms:2,3-propanetricarboxylicacid,2-(1-oxobutoxy)-trihexylester;trihexylo-butyrylcitrate;BTHC;TRIHEXYL O-BUTYRYLCITRATE 99%;butyryl-n-trihexylcitrate;
CAS:82469-79-2
Molecular Formula: C28H50O8
Molecular Weight: 514.7
InChI: InChI=1/C28H50O8/c1-5-9-12-15-19-33-25(30)22-28(36-24(29)18-8-4,27(32)35-21-17-14-11-7-3)23-26(31)34-20-16-13-10-6-2/h5-23H2,1-4H3
Molecular Structure: (C28H50O8) 2,3-propanetricarboxylicacid,2-(1-oxobutoxy)-trihexylester;trihexylo-butyrylcitrate;BTHC;TRIHEXYL O-...
Properties
Melting Point: −55 °C(lit.)
Flash Point: 213.9 ºC
Boiling Point: 522.3ºC at 760 mmHg
Density:0.993
Refractive index:n20/D 1.448(lit.)
Specification:

The n-Butyryl tri-n-hexyl citrate with the cas number 82469-79-2, is also called Butyryl-n-trihexylcitrate .Thr properties of the chemical are: (1)#H bond acceptors:  8  ; (2)#H bond donors:  0  ; (3)#Freely Rotating Bonds:  27  ; (4)Polar Surface Area:  105.2 Å2  ; (5)Index of Refraction:  1.462  ; (6)Molar Refractivity:  138.83 cm ; (7)Molar Volume:  504.7 cm3  ; (8)Polarizability:  55.03×10-24cm ; (9)Surface Tension:  36.4 dyne/cm  ; (10)Enthalpy of Vaporization:  79.57 kJ/mol  ; (11)Vapour Pressure:  5.25×10-11 mmHg at 25°C .

The product can be supplied by the following suppliers: (1)Jiangsu Lemon Chemical & Technology Co., Ltd.; (2)Sinopec Jinling Petrochemical Corp Tech-Development Corp; (3)Nanjing Chemlin Chemical Co., Ltd.; (4)Shanghai Haiqu Chemical Co., Ltd.; (5)Leap Labchem Co.,Ltd.; (6)Jiangsu Tianpeng Tongren Fine Chemical Co., Ltd.; (7)Jiangsu Tianyin Chemical Industry Co., Ltd..

You can still convert the following datas into molecular structure :
1.O=C(OCCCCCC)CC(OC(=O)CCC)(C(=O)OCCCCCC)CC(=O)OCCCCCC   
2.InChI=1/C28H50O8/c1-5-9-12-15-19-33-25(30)22-28(36-24(29)18-8-4,27(32)35-21-17-14-11-7-3)23-26(31)34-20-16-13-10-6-2/h5-23H2,1-4H3

Flash Point: 213.9 ºC
Safety Data