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Afloqualone chemical structure, C16H14FN3O, CAS 56287-74-2
2D chemical structure

Key facts

What buyers check first

CAS number
56287-74-2
Formula
C16H14FN3O
Molar mass
283.31 g/mol
EC number
109-719-5
HS code
293359
Category
Heterocyclic building blocks

What is Afloqualone?

Plain description, key identifiers and synonyms

Afloqualone is an organic molecular entity.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
6-amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4-one
CAS number
56287-74-2 CAS number cross-checked
EC number
109-719-5
Molecular formula
C16H14FN3O
UNII
CO4U2C8ORZ
MDL number
MFCD00867693
InChIKey
VDOSWXIDETXFET-UHFFFAOYSA-N
InChI
InChI=1S/C16H14FN3O/c1-10-4-2-3-5-14(10)20-15(9-17)19-13-7-6-11(18)8-12(13)16(20)21/h2-8H,9,18H2,1H3
SMILES (canonical and isomeric)
CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)N)CF

Synonyms

  • Airomate
  • Afloqualonum
  • Aflocualona
  • 6-amino-2-(fluoromethyl)-3-(o-tolyl)-4(3H)-quinazolinone
  • 6-Amino-2-fluoromethyl-3-(2-tolyl)-3H-quinazolin-4-one
  • Arofuto
  • 4(3H)-Quinazolinone, 6-amino-2-(fluoromethyl)-3-(2-methylphenyl)-
  • 6-amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4-one
  • 6-Amino-2-(fluoromethyl)-3-(2-methylphenyl)-quinazolin-4-one
  • 6-amino-2-(fluoromethyl)-3-(2-methylphenyl)-4(3H)-Quinazolinone
  • 6-Amino-2-(fluoromethyl)-3-o-tolyl-4(3H)-quinazolinone
  • 6-amino-2-(fluoromethyl)-3-(o-tolyl)quinazolin-4(3H)-one
  • Afloqualon
  • 6-amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4(3H)-one
  • Afloqualona
  • HQ 495
  • Airomate (TN)
  • 6-Amino-2-(fluoromethyl)-3-o-tolyl-4(3H)-chinazolinon
  • Afloqualone (Standard)
  • 6-Amino-3,4-dihydro-2-fluoromethyl-3-(2-methylphenyl)-4-chinazolinon
  • Afloqualone (JP18/INN)
  • 6-amino-2-(fluoromethyl)-3-(o-tolyl)quinazolin-4-one
  • 2-fluoromethyl-3-(o-tolyl)-6-amino-4(3H)-quinazolinone

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
283.31 g/molcalc.
Exact mass
283.1121 Dacalc.
LogP (octanol/water)
2.75calc.
Topological polar surface area
60.91 ร…ยฒcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
2calc.
Heavy atoms
21calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.13calc.
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=c1c2ccccc2ncn1-c1ccccc1

O=c1c2ccccc2ncn1-c1ccccc1

3 rings, 17 atoms, the 3-Phenyl-3H-quinazolin-4-one ring system.

982 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H319Causes serious eye irritation.
Precautionary statements (4)
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P337 + P317If eye irritation persists: Get medical help.

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

Full safety data and first aid

Afloqualone suppliers

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Afloqualone price

Indicative price range per kg from live supplier offers

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Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Muscle Relaxants, Central
  • Photosensitizing Agents

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 Afloqualone is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Afloqualone?

Afloqualone is an organic molecular entity.

What is the CAS number of Afloqualone?

The CAS registry number of Afloqualone is 56287-74-2.

What is the molecular formula and weight of Afloqualone?

The molecular formula of Afloqualone is C16H14FN3O and its molar mass is 283.31 g/mol.

What is Afloqualone used for?

Known uses and roles of Afloqualone include building blocks in research and laboratory, screening compounds in research and laboratory, muscle relaxants, central and photosensitizing agents.

Is Afloqualone hazardous?

Afloqualone carries the GHS signal word "Warning". Main hazards: causes serious eye irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Afloqualone?

Afloqualone is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ringโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Afloqualone?

CompoundList lists 7 suppliers of Afloqualone in China, United States, Australia, Japan and 1 more. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Afloqualone?

Suppliers quote Afloqualone 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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