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Aromatic building blocks

3,5-Dinitroacetophenone

Also known as 1-(3,5-dinitrophenyl)ethanone, 3',5'-Dinitroacetophenone, Ethanone, 1-(3,5-dinitrophenyl)-

CAS 14401-75-3Formula C8H6N2O5Molar mass 210.15 g/molEC 625-197-6
GHS signal word: Danger. Pictograms: Corrosive, Harmful or irritant 1 supplier listed
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3,5-Dinitroacetophenone chemical structure, C8H6N2O5, CAS 14401-75-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
14401-75-3
Formula
C8H6N2O5
Molar mass
210.15 g/mol
EC number
625-197-6
HS code
291479
Category
Aromatic building blocks

What is 3,5-Dinitroacetophenone?

Plain description, key identifiers and synonyms

3,5-Dinitroacetophenone is a chemical substance with the molecular formula C8H6N2O5 and a molar mass of 210.15 g/mol. Its CAS registry number is 14401-75-3. The IUPAC name is 1-(3,5-dinitrophenyl)ethanone.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-(3,5-dinitrophenyl)ethanone
CAS number
14401-75-3 CAS number cross-checked
EC number
625-197-6
Molecular formula
C8H6N2O5
MDL number
MFCD00631987
InChIKey
WGJQPJOLPLYFJH-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O5/c1-5(11)6-2-7(9(12)13)4-8(3-6)10(14)15/h2-4H,1H3
SMILES (canonical and isomeric)
CC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

Synonyms

  • 1-(3,5-dinitrophenyl)ethanone
  • 3',5'-Dinitroacetophenone
  • Ethanone, 1-(3,5-dinitrophenyl)-
  • 1-(3,5-Dinitrophenyl)ethan-1-one
  • 1-acetyl-3,5-dinitrobenzene
  • 3',5'-Dinitroacetophenone, 97%

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
210.15 g/molcalc.
Exact mass
210.0277 Dacalc.
LogP (octanol/water)
1.71calc.
Topological polar surface area
103.4 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
3calc.
Heavy atoms
15calc.
Rings
1calc.
Aromatic rings
1calc.
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, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Danger
GHS05: Corrosive
Corrosive
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H317May cause an allergic skin reaction.
  • H318Causes serious eye damage.
Precautionary statements (11)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P272Contaminated work clothing should not be allowed out of the workplace.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P305 + P354 + P338If in eyes: Immediately rinse with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P317Get medical help.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P333 + P317If skin irritation or rash occurs: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • 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

3,5-Dinitroacetophenone suppliers

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Where suppliers are based

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3,5-Dinitroacetophenone price

Indicative price range per kg from live supplier offers

No published prices right now

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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 3,5-Dinitroacetophenone is traded under.

HS 2914.79Indicative HS code

Halogenated, sulphonated, nitrated or nitrosated derivatives, other

World exports in 2024
$558M
−12.1% vs 2023, imports $608M
2019 to 2024
Top exporters
  1. China41.2%
  2. India * partner reported28.7%
  3. Germany16.7%
Top importers
  1. United States29.1%
  2. Italy9.9%
  3. Switzerland * partner reported8.8%

* Partner reported figures, a lower bound.

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

The HS code shown for 3,5-Dinitroacetophenone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 3,5-Dinitroacetophenone, based on the data on this page

What is 3,5-Dinitroacetophenone?

3,5-Dinitroacetophenone is a chemical substance with the molecular formula C8H6N2O5 and a molar mass of 210.15 g/mol. Its CAS registry number is 14401-75-3. The IUPAC name is 1-(3,5-dinitrophenyl)ethanone.

What is the CAS number of 3,5-Dinitroacetophenone?

The CAS registry number of 3,5-Dinitroacetophenone is 14401-75-3.

What is the molecular formula and weight of 3,5-Dinitroacetophenone?

The molecular formula of 3,5-Dinitroacetophenone is C8H6N2O5 and its molar mass is 210.15 g/mol.

What is 3,5-Dinitroacetophenone used for?

Known uses and roles of 3,5-Dinitroacetophenone include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 3,5-Dinitroacetophenone hazardous?

3,5-Dinitroacetophenone carries the GHS signal word "Danger". Main hazards: may cause an allergic skin reaction, causes serious eye damage. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of 3,5-Dinitroacetophenone?

3,5-Dinitroacetophenone is usually classified under HS code 291479 (Halogenated, sulphonated, nitrated or nitrosated derivatives, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 3,5-Dinitroacetophenone?

CompoundList lists 1 supplier of 3,5-Dinitroacetophenone in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of 3,5-Dinitroacetophenone?

Suppliers quote 3,5-Dinitroacetophenone 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 3,5-Dinitroacetophenone

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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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