Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Tocofibrate
Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

Tocofibrate

 EINECS N/A
CAS No. 50465-39-9 Density 1.019g/cm3
PSA 44.76000 LogP 11.55100
Solubility N/A Melting Point N/A
Formula C39H59 Cl O4 Boiling Point 670.7°C at 760 mmHg
Molecular Weight 627.43 Flash Point 150.8°C
Transport Information N/A Appearance N/A
Safety Mildly toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−. Risk Codes N/A
Molecular Structure Molecular Structure of 50465-39-9 (Tocofibrate) Hazard Symbols N/A
Synonyms

Propanoicacid, 2-(4-chlorophenoxy)-2-methyl-,3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ylester, [2R*(4R*,8R*)]-(?à)-; Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-,3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ylester, [2R*(4R*,8R*)]-; Tocofibrate

 

Tocofibrate Chemical Properties

Molecule structure of Tocofibrate (CAS NO.50465-39-9) :

IUPAC Name: [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] 2-(4-chlorophenoxy)-2-methylpropanoate 
Molecular Weight: 627.33636 g/mol
Molecular Formula: C39H59ClO4
Density: 1.019 g/cm3 
Boiling Point: 670.7 °C at 760 mmHg 
Flash Point: 150.8 °C
Index of Refraction: 1.512
Molar Refractivity: 184.9 cm3
Molar Volume: 615.3 cm3
Polarizability: 73.3×10-24 cm3
Surface Tension: 36.4 dyne/cm 
Enthalpy of Vaporization: 98.55 kJ/mol
Vapour Pressure: 7.48E-18 mmHg at 25 °C
XLogP3-AA: 13.7 
H-Bond Acceptor: 4
Rotatable Bond Count: 17
Exact Mass: 626.410188
MonoIsotopic Mass: 626.410188
Topological Polar Surface Area: 44.8
Heavy Atom Count: 44
Complexity: 851
Defined Atom StereoCenter Count: 3
Canonical SMILES: CC1=C2C(=C(C(=C1C)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C)CCC(O2)(C)CCCC(C)CCCC
(C)CCCC(C)C
Isomeric SMILES: CC1=C2C(=C(C(=C1C)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C)CC[C@@](O2)(C)CCC[C@H]
(C)CCC[C@H](C)CCCC(C)C
InChI: InChI=1S/C39H59ClO4/c1-26(2)14-11-15-27(3)16-12-17-28(4)18-13-24-39(10)25-23-34-31(7)35(29(5)30(6)36(34)44-39)42-37(41)38(8,9)43-33-21-19-32(40)20-22-33/h19-22,26-28H,11-18,23-25H2,1-10H3/t27-,28-,39-/m1/s1
InChIKey of Tocofibrate (CAS NO.50465-39-9) : VPRFDABTJNLKKR-XHZSPPMBSA-N

Tocofibrate Toxicity Data With Reference

1.    

orl-rat LD50:15 g/kg

     DRFUD4    Drugs of the Future. 4 (1979),679.
2.    

ipr-rat LD50:15 g/kg

     DRFUD4    Drugs of the Future. 4 (1979),679.
3.    

orl-mus LD50:15 g/kg

     DRFUD4    Drugs of the Future. 4 (1979),679.
4.    

ipr-mus LD50:15 g/kg

     DRFUD4    Drugs of the Future. 4 (1979),679.

Tocofibrate Safety Profile

Mildly toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl−.

Tocofibrate Specification

 Tocofibrate (CAS NO.50465-39-9) is also called Tocoferol 2-(p-chlorophenoxy)-2-methylpropionate ; Tocofibrato ; Tocofibrato [INN-Spanish] ; Tocofibrato [Spanish] ; Tocofibratum ; Tocofibratum [INN-Latin] ; 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanyl 2-(p-chlorophenoxy)-2-methylpropionate ; Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl ester, (2R(4R,8R))- .

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 50465-39-9