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Screening compounds

Simfibrate

Also known as Cholesolvin, Simfibratum, Simfibrato

CAS 14929-11-4Formula C23H26Cl2O6Molar mass 469.36 g/molEC 238-998-7
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Simfibrate chemical structure, C23H26Cl2O6, CAS 14929-11-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
14929-11-4
Formula
C23H26Cl2O6
Molar mass
469.36 g/mol
EC number
238-998-7
HS code
291899
Category
Screening compounds

What is Simfibrate?

Plain description, key identifiers and synonyms

Simfibrate is an organic molecular entity.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxypropyl 2-(4-chlorophenoxy)-2-methylpropanoate
CAS number
14929-11-4 CAS number cross-checked
EC number
238-998-7
Molecular formula
C23H26Cl2O6
UNII
L2R75RQX26
InChIKey
JLRNKCZRCMIVKA-UHFFFAOYSA-N
InChI
InChI=1S/C23H26Cl2O6/c1-22(2,30-18-10-6-16(24)7-11-18)20(26)28-14-5-15-29-21(27)23(3,4)31-19-12-8-17(25)9-13-19/h6-13H,5,14-15H2,1-4H3
SMILES (canonical and isomeric)
CC(C)(C(=O)OCCCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl

Synonyms

  • Cholesolvin
  • Simfibratum
  • Simfibrato
  • 1,3-propanediol bis(alpha-p-chlorophenoxyisobutyrate)
  • 3-((2-(4-chlorophenoxy)-2-methylpropanoyl)oxy)propyl 2-(4-chlorophenoxy)-2-methylpropanoate
  • Propane-1,3-diyl bis(2-(4-chlorophenoxy)-2-methylpropanoate)
  • Sinfibrate
  • 3-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxypropyl 2-(4-chlorophenoxy)-2-methylpropanoate
  • Sinfibrato
  • Propane-1,3-diyl bis[2-(4-chlorophenoxy)-2-methylpropanoate]
  • Cholesolvin (TN)
  • 1,3-Propanediol bis(alpha-(p-chlorophenoxy)isobutyrate)
  • 1,3-Propanediol bis(2-(4-chlorophenoxy)-2-methylpropionate)
  • 2-(p-Chlorophenoxy)-2-methylpropionic acid trimethylene ester
  • Simfibrate (JAN/INN)
  • 2-(4-Chlorophenoxy)-2-methylpropanoic acid 1,3-propanediyl ester
  • Simfibrate - API Standards
  • Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,3-propanediyl ester

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
469.36 g/molcalc.
Exact mass
468.1106 Dacalc.
LogP (octanol/water)
5.48calc.
Topological polar surface area
71.06 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
10calc.
Heavy atoms
31calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.39calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(COc1ccccc1)OCCCOC(=O)COc1ccccc1

O=C(COc1ccccc1)OCCCOC(=O)COc1ccccc1

2 rings, 25 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Simfibrate suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

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Simfibrate price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Roles

  • cardiovascular drug
  • pharmaceutical

Pharmacology

Simfibrate is a derivative of clofibrate with antilipidemic activity.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Simfibrate is traded under.

HS 2918.99Indicative HS code

Carboxylic acids, with additional oxygen function (not alcohol, phenol, aldehyde or ketone)…

World exports in 2024
$1.46B
−1.1% vs 2023, imports $1.54B
2019 to 2024
Top exporters
  1. China40.0%
  2. India * partner reported26.6%
  3. Germany8.0%
Top importers
  1. United States25.6%
  2. Brazil6.7%
  3. Argentina5.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Simfibrate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Simfibrate, based on the data on this page

What is Simfibrate?

Simfibrate is an organic molecular entity.

What is the CAS number of Simfibrate?

The CAS registry number of Simfibrate is 14929-11-4.

What is the molecular formula and weight of Simfibrate?

The molecular formula of Simfibrate is C23H26Cl2O6 and its molar mass is 469.36 g/mol.

What is Simfibrate used for?

Known uses and roles of Simfibrate include building blocks in research and laboratory, screening compounds in research and laboratory, cardiovascular drug and pharmaceutical.

Is Simfibrate hazardous?

No GHS hazard classification for Simfibrate is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Simfibrate?

Simfibrate is usually classified under HS code 291899 (Carboxylic acids with additional oxygen function and their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Simfibrate?

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What is the price of Simfibrate?

Suppliers quote Simfibrate on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Simfibrate

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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