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Heterocyclic building blocks

Agn-PC-080bcx

Also known as N-octadec-9,12-dienoylpyrrolidine, 1-(Pyrrolidin-1-yl)octadeca-9,12-dien-1-one

CAS 56630-36-5Formula C22H39NOMolar mass 333.56 g/mol
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Agn-PC-080bcx chemical structure, C22H39NO, CAS 56630-36-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
56630-36-5
Formula
C22H39NO
Molar mass
333.56 g/mol
HS code
293399
Category
Heterocyclic building blocks

What is Agn-PC-080bcx?

Plain description, key identifiers and synonyms

Agn-PC-080bcx is a chemical substance with the molecular formula C22H39NO and a molar mass of 333.56 g/mol. Its CAS registry number is 56630-36-5. The IUPAC name is 1-pyrrolidin-1-yloctadeca-9,12-dien-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-pyrrolidin-1-yloctadeca-9,12-dien-1-one
CAS number
56630-36-5 CAS number cross-checked
Molecular formula
C22H39NO
InChIKey
RLJFUUUSNKIMQJ-UHFFFAOYSA-N
InChI
InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h6-7,9-10H,2-5,8,11-21H2,1H3
SMILES (canonical and isomeric)
CCCCCC=CCC=CCCCCCCCC(=O)N1CCCC1

Synonyms

  • N-octadec-9,12-dienoylpyrrolidine
  • 1-(Pyrrolidin-1-yl)octadeca-9,12-dien-1-one

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
333.56 g/molcalc.
Exact mass
333.3032 Dacalc.
LogP (octanol/water)
6.42calc.
Topological polar surface area
20.31 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
14calc.
Heavy atoms
24calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.77calc.
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, C1CCNC1

C1CCNC1

1 ring, 5 atoms, the Pyrrolidine ring system.

22,348 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.

Agn-PC-080bcx suppliers

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Agn-PC-080bcx 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 Agn-PC-080bcx 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 Agn-PC-080bcx is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Agn-PC-080bcx, based on the data on this page

What is Agn-PC-080bcx?

Agn-PC-080bcx is a chemical substance with the molecular formula C22H39NO and a molar mass of 333.56 g/mol. Its CAS registry number is 56630-36-5. The IUPAC name is 1-pyrrolidin-1-yloctadeca-9,12-dien-1-one.

What is the CAS number of Agn-PC-080bcx?

The CAS registry number of Agn-PC-080bcx is 56630-36-5.

What is the molecular formula and weight of Agn-PC-080bcx?

The molecular formula of Agn-PC-080bcx is C22H39NO and its molar mass is 333.56 g/mol.

What is Agn-PC-080bcx used for?

Known uses and roles of Agn-PC-080bcx include building blocks in research and laboratory.

Is Agn-PC-080bcx hazardous?

No GHS hazard classification for Agn-PC-080bcx 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 Agn-PC-080bcx?

Agn-PC-080bcx 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 Agn-PC-080bcx?

Post a free request on CompoundList and suppliers of Agn-PC-080bcx will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Agn-PC-080bcx?

Suppliers quote Agn-PC-080bcx 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 Agn-PC-080bcx

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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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