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Profluralin chemical structure, C14H16F3N3O4, CAS 26399-36-0
2D chemical structure

Key facts

What buyers check first

Appearance
Yellow-orange crystals
Melting point
32.1 to 32.5
Density
1.38 at 20 °C
Solubility
O.1 PPM IN WATER AT 27 °C, GREATER THAN 1 G/G OF ACETONE
HS code
292142
Category
Herbicides
Illustrative photo, yellow pigment powder in an open kraft paper sack in a chemical plant
Typical packagingIllustrative packaging image, not the actual product

What is Profluralin?

Plain description, key identifiers and synonyms

Profluralin is a C-nitro compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)aniline
CAS number
26399-36-0 CAS number cross-checked
EC number
247-656-6
Molecular formula
C14H16F3N3O4
UNII
36W2L722UX
MDL number
MFCD00055480
InChIKey
ITVQAKZNYJEWKS-UHFFFAOYSA-N
InChI
InChI=1S/C14H16F3N3O4/c1-2-5-18(8-9-3-4-9)13-11(19(21)22)6-10(14(15,16)17)7-12(13)20(23)24/h6-7,9H,2-5,8H2,1H3
SMILES (canonical and isomeric)
CCCN(CC1CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Synonyms

  • Pregard
  • Tolban
  • Profluraline
  • CGA 10832
  • SGA 10832
  • N-(Cyclopropylmethyl)-2,6-dinitro-n-propyl-4-(trifluoromethyl)aniline
  • Benzenamine, N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)-
  • N-(Cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)benzenamine
  • N-Cyclopropylmethyl-N-n-propyl-4-trifluoromethyl-2,6-dinitroaniline
  • N-Cyclopropylmethyl-2,6-dinitro-N-propyl-4-trifluoromethylaniline
  • N-(Cyclopropylmethyl)-alpha,alpha,alpha-trifluoro-2,6-dinitro-N-propyl-p-toluidine
  • p-Toluidine, N-(cyclopropylmethyl)-alpha,alpha,alpha-trifluoro-2,6-dinitro-N-propyl-
  • p-Toluidine, N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-alpha,alpha,alpha-trifluoro-
  • Profluraline [ISO-French]
  • ER 5461
  • Profluralin, PESTANAL(R), analytical standard
  • N-cyclopropylmethyl-2,6-dinitro -N-propyl-4-(trifluoromethyl)benzenamine
  • N-Cyclopropylmethyl-n-propyl-4-trifluoromethyl-2,6-dinitroaniline
  • N-Cyclopropylmethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-n-propyl-p-toluidine

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

Appearance
Yellow-orange crystalsexp.
Odour
NO APPRECIABLE ODORexp.
Melting point
32.1 to 32.5exp.
Density
1.38 at 20 °Cexp.
Solubility
O.1 PPM IN WATER AT 27 °C, GREATER THAN 1 G/G OF ACETONEexp.
Vapour pressure
6.3 × 10⁻⁵ mm Hg at 20 °Cexp.

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
347.29 g/molcalc.
Exact mass
347.1093 Dacalc.
LogP (octanol/water)
4.15calc.
Topological polar surface area
89.52 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
7calc.
Heavy atoms
24calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.57calc.
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, c1ccc(NCC2CC2)cc1

c1ccc(NCC2CC2)cc1

2 rings, 11 atoms, the N-(Cyclopropylmethyl)aniline ring system.

382 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
GHS09: Hazardous to the environment
Hazardous to the environment

Hazard statements

  • H319Causes serious eye irritation.
  • H400Very toxic to aquatic life.
  • H410Very toxic to aquatic life with long lasting effects.
Precautionary statements (7)
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P273Avoid release to the environment.
  • 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.
  • P391Collect spillage.
  • P501Dispose of contents and container in accordance with local regulations.

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

Profluralin suppliers

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Profluralin 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

Selective pre-planting herbicide (former use).

How it is made

Benzotrifluorides are also important in the production of pesticides. The key intermediate, 4-chloro-3,5-dinitrobenzotrifluoride, is obtained by dinitration of 4-chlorobenzotrifluoride. Reaction with secondary amines gives ... profluralin.

It can be made by reacting 4-chloro-3,5-dinitro benzotrifluoride with n-cyclopropylmethyl-n-n-propylamine.

Regulatory status

Inventories, regulations and trade controls that list this substance

Europe

  • EU harmonised classification (CLP Annex VI)
    Index no: 613-059-00-8

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Profluralin is traded under.

HS 2921.42Indicative HS code

Aniline derivatives and their salts

World exports in 2024
$495M
−2.5% vs 2023, imports $440M
2019 to 2024
Top exporters
  1. China69.8%
  2. India * partner reported19.6%
  3. Japan3.3%
Top importers
  1. Pakistan17.0%
  2. United Arab Emirates * partner reported12.7%
  3. Brazil10.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Profluralin?

Profluralin is a C-nitro compound.

What is the CAS number of Profluralin?

The CAS registry number of Profluralin is 26399-36-0.

What is the molecular formula and weight of Profluralin?

The molecular formula of Profluralin is C14H16F3N3O4 and its molar mass is 347.29 g/mol.

What is Profluralin used for?

Selective pre-planting herbicide (former use).

Is Profluralin hazardous?

Profluralin carries the GHS signal word "Warning". Main hazards: causes serious eye irritation, very toxic to aquatic life, very toxic to aquatic life with long lasting effects. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Profluralin?

Profluralin is usually classified under HS code 292142 (Aniline derivatives and their salts). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Profluralin?

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What is the price of Profluralin?

Suppliers quote Profluralin 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 Profluralin

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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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