Tocofibrate

[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] 2-(4-chlorophenoxy)-2-methylpropanoate

CAS: 50465-39-9

Molecular Formula	`C39H59ClO4`
Molecular Weight	627.3 g/mol
LogP	13.7
Topological Polar Surface Area	44.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	17
Exact Mass	626.4102
Heavy Atoms	44
Complexity	851.0

Chemical Identifiers

CAS Number	50465-39-9
SMILES	`CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C`
InChIKey	`VPRFDABTJNLKKR-XHZSPPMBSA-N`

📖 Product Overview

Tocofibrate (CAS: 50465-39-9) is a chemical compound with molecular formula C39H59ClO4 and molecular weight 627.3 g/mol. Its IUPAC systematic name is [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] 2-(4-chlorophenoxy)-2-methylpropanoate. LogP 13.7 Topological Polar Surface Area 44.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 17 Exact Mass 626.4102 Heavy Atoms 44 Complexity 851.0 InChI Key: VPRFDABTJNLKKR-XHZSPPMBSA-N. SMILES: CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C.

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