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Heterocyclic building blocks

2-Pyrazinylmethyl cyclohexanecarboxylate

CAS 72789-30-1Formula C12H16N2O2Molar mass 220.27 g/mol
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2-Pyrazinylmethyl cyclohexanecarboxylate chemical structure, C12H16N2O2, CAS 72789-30-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
72789-30-1
Formula
C12H16N2O2
Molar mass
220.27 g/mol
HS code
293399
Category
Heterocyclic building blocks

What is 2-Pyrazinylmethyl cyclohexanecarboxylate?

Plain description, key identifiers and synonyms

2-Pyrazinylmethyl cyclohexanecarboxylate is a chemical substance with the molecular formula C12H16N2O2 and a molar mass of 220.27 g/mol. Its CAS registry number is 72789-30-1. The IUPAC name is pyrazin-2-ylmethyl cyclohexanecarboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
pyrazin-2-ylmethyl cyclohexanecarboxylate
CAS number
72789-30-1
Molecular formula
C12H16N2O2
InChIKey
IMUXSDVNOKBYSG-UHFFFAOYSA-N
InChI
InChI=1S/C12H16N2O2/c15-12(10-4-2-1-3-5-10)16-9-11-8-13-6-7-14-11/h6-8,10H,1-5,9H2
SMILES (canonical and isomeric)
C1CCC(CC1)C(=O)OCC2=NC=CN=C2

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
220.27 g/molcalc.
Exact mass
220.1212 Dacalc.
LogP (octanol/water)
2.1calc.
Topological polar surface area
52.08 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
16calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.58calc.
Formal charge
0calc.
Stereocentres
0calc.
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=C(OCc1cnccn1)C1CCCCC1

O=C(OCc1cnccn1)C1CCCCC1

2 rings, 16 atoms. This chemical is the scaffold itself.

No other chemical in our database has 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.

2-Pyrazinylmethyl cyclohexanecarboxylate suppliers

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2-Pyrazinylmethyl cyclohexanecarboxylate 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 2-Pyrazinylmethyl cyclohexanecarboxylate is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

The HS code shown for 2-Pyrazinylmethyl cyclohexanecarboxylate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 2-Pyrazinylmethyl cyclohexanecarboxylate, based on the data on this page

What is 2-Pyrazinylmethyl cyclohexanecarboxylate?

2-Pyrazinylmethyl cyclohexanecarboxylate is a chemical substance with the molecular formula C12H16N2O2 and a molar mass of 220.27 g/mol. Its CAS registry number is 72789-30-1. The IUPAC name is pyrazin-2-ylmethyl cyclohexanecarboxylate.

What is the CAS number of 2-Pyrazinylmethyl cyclohexanecarboxylate?

The CAS registry number of 2-Pyrazinylmethyl cyclohexanecarboxylate is 72789-30-1.

What is the molecular formula and weight of 2-Pyrazinylmethyl cyclohexanecarboxylate?

The molecular formula of 2-Pyrazinylmethyl cyclohexanecarboxylate is C12H16N2O2 and its molar mass is 220.27 g/mol.

What is 2-Pyrazinylmethyl cyclohexanecarboxylate used for?

Known uses and roles of 2-Pyrazinylmethyl cyclohexanecarboxylate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 2-Pyrazinylmethyl cyclohexanecarboxylate hazardous?

No GHS hazard classification for 2-Pyrazinylmethyl cyclohexanecarboxylate 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 2-Pyrazinylmethyl cyclohexanecarboxylate?

2-Pyrazinylmethyl cyclohexanecarboxylate is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 2-Pyrazinylmethyl cyclohexanecarboxylate?

Post a free request on CompoundList and suppliers of 2-Pyrazinylmethyl cyclohexanecarboxylate will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 2-Pyrazinylmethyl cyclohexanecarboxylate?

Suppliers quote 2-Pyrazinylmethyl cyclohexanecarboxylate 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 2-Pyrazinylmethyl cyclohexanecarboxylate

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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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