Skip to the beginning of the images gallery

4-Nitro-2-(trifluoromethyl)acetanilide - 95%, high purity , CAS No.395-68-6

COA

Grade & Purity:

≥95%

Cas Number: 395-68-6
Molecular Weight: 248.2
PubChem CID: 540430

In stock

Item Number

N184268

Grouped product items
SKU	Size	Availability	Price	Qty
N184268-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
N184268-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$86.90

Discover 4-Nitro-2-(trifluoromethyl)acetanilide by Aladdin Scientific in 95% for only $19.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	395-68-6 \| 4-Nitro-2-(trifluoromethyl)acetanilide \| N-[4-Nitro-2-(trifluoromethyl)phenyl]acetamide \| 4'-Nitro-2'-(trifluoromethyl)acetanilide \| N-(4-Nitro-2-(trifluoromethyl)phenyl)acetamide \| Maybridge1_000035 \| MixCom1_000057 \| N1-[4-nitro-2-(trifluoromethyl)phenyl]a
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Anilides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Anilides
Intermediate Tree Nodes	Not available
Direct Parent	Acetanilides
Alternative Parents	Trifluoromethylbenzenes Nitrobenzenes N-acetylarylamines Nitroaromatic compounds Acetamides Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organofluorides Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Acetanilide - Trifluoromethylbenzene - Nitrobenzene - N-acetylarylamine - Nitroaromatic compound - N-arylamide - Acetamide - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Alkyl halide - Organopnictogen compound - Alkyl fluoride - Carbonyl group - Organic zwitterion - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as acetanilides. These are organic compounds containing an acetamide group conjugated to a phenyl group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	N-[4-nitro-2-(trifluoromethyl)phenyl]acetamide
INCHI	InChI=1S/C9H7F3N2O3/c1-5(15)13-8-3-2-6(14(16)17)4-7(8)9(10,11)12/h2-4H,1H3,(H,13,15)
InChIKey	RBEVUHKSMGYLIF-UHFFFAOYSA-N
Smiles	CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F
Isomeric SMILES	CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F
Molecular Weight	248.2
Reaxy-Rn	2662590
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2662590&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	248.160 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	248.041 Da
Monoisotopic Mass	248.041 Da
Topological Polar Surface Area	74.900 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	314.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration