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25812-30-0

25812-30-0 structural image
Product Name: Gemfibrozil
Formula: C15H22O3
Synonyms: 2,2-Dimethyl-5-(2,5-dimethylphenoxy)pentanoic acid;2,2-Dimethyl-5-(2,5-xylyloxy)valeric acid;5-(2,5-Dimethylphenoxy)-2,2-dimethylpentanoic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form Crystals from hexane
Boiling Point 158.5 °C at 2.00E-02 mm Hg
Melting Point 58-61
Solubility 2.78e-02 g/L
LogP 4.387
Collision Cross Section 167.81 Ų [M+Na]+ 152.1 Ų [M+H]+ 168.34 Ų [M-H]-

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 250.33 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 250.15689456 g/mol
Monoisotopic Mass 250.15689456 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 273
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Gemfibrozil is an aromatic ether. It has a role as an antilipemic drug. It is functionally related to a valeric acid.

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