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Screening compounds

Metproxybicyclone

Also known as 3-[2-Methoxy-4-(1-propyn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl carbonate, (1RS,5SR)-3-[2-methoxy-4-(prop-1-yn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl carbonate, Carbonic acid, 3-[2-methoxy-4-(1-propyn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl ester

CAS 1848207-89-5Formula C20H20O5Molar mass 340.38 g/mol
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Metproxybicyclone chemical structure, C20H20O5, CAS 1848207-89-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1848207-89-5
Formula
C20H20O5
Molar mass
340.38 g/mol
HS code
292090
Category
Screening compounds

What is Metproxybicyclone?

Plain description, key identifiers and synonyms

Metproxybicyclone is a chemical substance with the molecular formula C20H20O5 and a molar mass of 340.38 g/mol. Its CAS registry number is 1848207-89-5. The IUPAC name is [(1R,5S)-3-(2-methoxy-4-prop-1-ynylphenyl)-4-oxo-2-bicyclo[3.2.1]oct-2-enyl] methyl carbonate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1R,5S)-3-(2-methoxy-4-prop-1-ynylphenyl)-4-oxo-2-bicyclo[3.2.1]oct-2-enyl] methyl carbonate
CAS number
1848207-89-5
Molecular formula
C20H20O5
UNII
JP7D8BK869
InChIKey
BLGCYYLLSINBMU-UONOGXRCSA-N
InChI
InChI=1S/C20H20O5/c1-4-5-12-6-9-15(16(10-12)23-2)17-18(21)13-7-8-14(11-13)19(17)25-20(22)24-3/h6,9-10,13-14H,7-8,11H2,1-3H3/t13-,14+/m0/s1
Canonical SMILES
CC#Cc1ccc(C2=C(OC(=O)OC)C3CCC(C3)C2=O)c(OC)c1
Isomeric SMILES
CC#CC1=CC(=C(C=C1)C2=C([C@@H]3CC[C@@H](C3)C2=O)OC(=O)OC)OC

Synonyms

  • 3-[2-Methoxy-4-(1-propyn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl carbonate
  • (1RS,5SR)-3-[2-methoxy-4-(prop-1-yn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl carbonate
  • Carbonic acid, 3-[2-methoxy-4-(1-propyn-1-yl)phenyl]-4-oxobicyclo[3.2.1]oct-2-en-2-yl methyl 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
340.38 g/molcalc.
Exact mass
340.1311 Dacalc.
LogP (octanol/water)
3.56calc.
Topological polar surface area
61.83 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
3calc.
Heavy atoms
25calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.4calc.
Formal charge
0calc.
Stereocentres
2calc.
Lipinski rule of five
Passes (0 violations)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=C1C(c2ccccc2)=CC2CCC1C2

O=C1C(c2ccccc2)=CC2CCC1C2

3 rings, 15 atoms.

2 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.

Metproxybicyclone suppliers

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Metproxybicyclone price

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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 Metproxybicyclone is traded under.

HS 2920.90Indicative HS code

Esters, other than thiophosphoric esters (phosphorothioates) and phosphite esters and their salts…

World exports in 2024
$1.05B
+8.0% vs 2023, imports $1.23B
2019 to 2024
Top exporters
  1. China33.4%
  2. Germany18.8%
  3. United States12.4%
Top importers
  1. United States19.2%
  2. Singapore8.9%
  3. South Korea6.9%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Metproxybicyclone?

Metproxybicyclone is a chemical substance with the molecular formula C20H20O5 and a molar mass of 340.38 g/mol. Its CAS registry number is 1848207-89-5. The IUPAC name is [(1R,5S)-3-(2-methoxy-4-prop-1-ynylphenyl)-4-oxo-2-bicyclo[3.2.1]oct-2-enyl] methyl carbonate.

What is the CAS number of Metproxybicyclone?

The CAS registry number of Metproxybicyclone is 1848207-89-5.

What is the molecular formula and weight of Metproxybicyclone?

The molecular formula of Metproxybicyclone is C20H20O5 and its molar mass is 340.38 g/mol.

What is Metproxybicyclone used for?

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

Is Metproxybicyclone hazardous?

No GHS hazard classification for Metproxybicyclone 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 Metproxybicyclone?

Metproxybicyclone is usually classified under HS code 292090 (Esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Metproxybicyclone?

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

What is the price of Metproxybicyclone?

Suppliers quote Metproxybicyclone 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

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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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