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3-Nitro-4-(trifluoromethoxy)aniline - 98%, high purity , CAS No.2822-50-6

COA

Grade & Purity:

≥98%

Cas Number: 2822-50-6
Molecular Weight: 222.1
PubChem CID: 613694
PubChem SID: 488190743

In stock

Item Number

N183411

Grouped product items
SKU	Size	Availability	Price
N183411-5g	5g	4	$11.90
N183411-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$45.90
N183411-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$144.90

Discover 3-Nitro-4-(trifluoromethoxy)aniline by Aladdin Scientific in 98% for only $11.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-Nitro-4-(trifluoromethoxy)aniline \| 2822-50-6 \| 4-(Trifluoromethoxy)-3-nitroaniline \| 5-Amino-2-(trifluoromethoxy)nitrobenzene \| Benzenamine,3-nitro-4-(trifluoromethoxy)- \| SCHEMBL1130254 \| 3-nitro-4-trifluoromethoxyaniline \| DTXSID20346634 \| 3-nitro-4-trifluoromethoxy
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrophenyl ethers
Alternative Parents	Phenoxy compounds Phenol ethers Nitroaromatic compounds Aniline and substituted anilines Trihalomethanes Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organopnictogen compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrophenyl ether - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - C-nitro compound - Organic nitro compound - Trihalomethane - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Amine - Alkyl halide - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Alkyl fluoride - Organohalogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Halomethane - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.
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

Pubchem Sid	488190743
IUPAC Name	3-nitro-4-(trifluoromethoxy)aniline
INCHI	InChI=1S/C7H5F3N2O3/c8-7(9,10)15-6-2-1-4(11)3-5(6)12(13)14/h1-3H,11H2
InChIKey	QXIKEFNBFUHDHK-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1N)[N+](=O)[O-])OC(F)(F)F
Isomeric SMILES	C1=CC(=C(C=C1N)[N+](=O)[O-])OC(F)(F)F
Molecular Weight	222.1
Reaxy-Rn	2736214
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2736214&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
E2527008	Certificate of Analysis	Jun 13, 2025	N183411
H2120343	Certificate of Analysis	Jun 19, 2024	N183411
H2120344	Certificate of Analysis	Jun 19, 2024	N183411
H2120345	Certificate of Analysis	Aug 27, 2021	N183411
D2323472	Certificate of Analysis	Aug 27, 2021	N183411

Chemical and Physical Properties

Flash Point(°C)	>110°C
Boil Point(°C)	300°/760mm
Molecular Weight	222.120 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Exact Mass	222.025 Da
Monoisotopic Mass	222.025 Da
Topological Polar Surface Area	81.100 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	241.000
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

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