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Screening compounds

5cHCaA2OdFP

Also known as 4-ethoxy-2,3-difluorophenyl 4-pentylcyclohexanecarboxylate, Cyclohexanecarboxylic acid, 4-pentyl-, 4-ethoxy-2,3-difluorophenyl ester, trans-

CAS 123560-54-3Formula C20H28F2O3Molar mass 354.44 g/mol
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5cHCaA2OdFP chemical structure, C20H28F2O3, CAS 123560-54-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
123560-54-3
Formula
C20H28F2O3
Molar mass
354.44 g/mol
HS code
291620
Category
Screening compounds

What is 5cHCaA2OdFP?

Plain description, key identifiers and synonyms

5cHCaA2OdFP is a chemical substance with the molecular formula C20H28F2O3 and a molar mass of 354.44 g/mol. Its CAS registry number is 123560-54-3. The IUPAC name is (4-ethoxy-2,3-difluorophenyl) 4-pentylcyclohexane-1-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4-ethoxy-2,3-difluorophenyl) 4-pentylcyclohexane-1-carboxylate
CAS number
123560-54-3
Molecular formula
C20H28F2O3
InChIKey
IUUNFMBRBVBFHE-UHFFFAOYSA-N
InChI
InChI=1S/C20H28F2O3/c1-3-5-6-7-14-8-10-15(11-9-14)20(23)25-17-13-12-16(24-4-2)18(21)19(17)22/h12-15H,3-11H2,1-2H3
SMILES (canonical and isomeric)
CCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OCC)F)F

Synonyms

  • 4-ethoxy-2,3-difluorophenyl 4-pentylcyclohexanecarboxylate
  • Cyclohexanecarboxylic acid, 4-pentyl-, 4-ethoxy-2,3-difluorophenyl ester, trans-

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
354.44 g/molcalc.
Exact mass
354.2007 Dacalc.
LogP (octanol/water)
5.66calc.
Topological polar surface area
35.53 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
8calc.
Heavy atoms
25calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.65calc.
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(Oc1ccccc1)C1CCCCC1

O=C(Oc1ccccc1)C1CCCCC1

2 rings, 15 atoms, the Phenyl cyclohexanecarboxylate ring system.

138 other chemicals 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.

5cHCaA2OdFP suppliers

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5cHCaA2OdFP 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

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 5cHCaA2OdFP is traded under.

HS 2916.20Indicative HS code

Cyclanic, cyclenic or cycloterpenic monocarboxylic acids, their anhydrides, halides…

World exports in 2024
$489M
−6.1% vs 2023, imports $608M
2019 to 2024
Top exporters
  1. China45.5%
  2. India * partner reported18.6%
  3. Japan11.2%
Top importers
  1. Brazil20.3%
  2. United States15.7%
  3. India * partner reported12.8%

* Partner reported figures, a lower bound.

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

The HS code shown for 5cHCaA2OdFP is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 5cHCaA2OdFP, based on the data on this page

What is 5cHCaA2OdFP?

5cHCaA2OdFP is a chemical substance with the molecular formula C20H28F2O3 and a molar mass of 354.44 g/mol. Its CAS registry number is 123560-54-3. The IUPAC name is (4-ethoxy-2,3-difluorophenyl) 4-pentylcyclohexane-1-carboxylate.

What is the CAS number of 5cHCaA2OdFP?

The CAS registry number of 5cHCaA2OdFP is 123560-54-3.

What is the molecular formula and weight of 5cHCaA2OdFP?

The molecular formula of 5cHCaA2OdFP is C20H28F2O3 and its molar mass is 354.44 g/mol.

What is 5cHCaA2OdFP used for?

Known uses and roles of 5cHCaA2OdFP include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 5cHCaA2OdFP hazardous?

No GHS hazard classification for 5cHCaA2OdFP 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 5cHCaA2OdFP?

5cHCaA2OdFP is usually classified under HS code 291620 (Cyclanic, cyclenic or cycloterpenic monocarboxylic acids, their anhydrides, halides…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 5cHCaA2OdFP?

Post a free request on CompoundList and suppliers of 5cHCaA2OdFP will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 5cHCaA2OdFP?

Suppliers quote 5cHCaA2OdFP 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 5cHCaA2OdFP

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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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