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2-Nitro-4-chloro-5-(trifluoromethyl)aniline - 95%, high purity , CAS No.167415-22-7

COA

Grade & Purity:

≥95%

Cas Number: 167415-22-7
Molecular Weight: 240.57
PubChem CID: 2737645
PubChem SID: 488192921

In stock

Item Number

A191423

Grouped product items
SKU	Size	Availability	Price
A191423-250mg	250mg	8	$9.90
A191423-1g	1g	8	$26.90
A191423-5g	5g	5	$67.90
A191423-25g	25g	2	$315.90
A191423-100g	100g	1	$1,137.90

Discover 2-Nitro-4-chloro-5-(trifluoromethyl)aniline by Aladdin Scientific in 95% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	167415-22-7 \| 4-Chloro-2-nitro-5-(trifluoromethyl)aniline \| 5-Amino-2-chloro-4-nitrobenzotrifluoride \| 2-Nitro-4-chloro-5-(trifluoromethyl)aniline \| Benzenamine, 4-chloro-2-nitro-5-(trifluoromethyl)- \| MFCD03094264 \| 3-amino-6-chloro-4-nitrobenzotrifluoride \| SCHEMBL46
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Trifluoromethylbenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Trifluoromethylbenzenes
Alternative Parents	Nitrobenzenes Nitroaromatic compounds Aniline and substituted anilines Chlorobenzenes Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organopnictogen compounds Organofluorides Organochlorides Organic zwitterions Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Alkyl halide - Organonitrogen compound - Organofluoride - Organochloride - Primary amine - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic zwitterion - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
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	488192921
IUPAC Name	4-chloro-2-nitro-5-(trifluoromethyl)aniline
INCHI	InChI=1S/C7H4ClF3N2O2/c8-4-2-6(13(14)15)5(12)1-3(4)7(9,10)11/h1-2H,12H2
InChIKey	HLEWKRQSGSZHGO-UHFFFAOYSA-N
Smiles	C1=C(C(=CC(=C1N)[N+](=O)[O-])Cl)C(F)(F)F
Isomeric SMILES	C1=C(C(=CC(=C1N)[N+](=O)[O-])Cl)C(F)(F)F
Molecular Weight	240.57
Reaxy-Rn	7377946
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7377946&ln=

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

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

Analytical Chart:

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10 results found

Lot Number	Certificate Type	Date	Item
D2325325	Certificate of Analysis	Mar 27, 2023	A191423
D2325334	Certificate of Analysis	Mar 27, 2023	A191423
D2325333	Certificate of Analysis	Mar 27, 2023	A191423
D2325339	Certificate of Analysis	Mar 27, 2023	A191423
D2325336	Certificate of Analysis	Mar 27, 2023	A191423
D2325331	Certificate of Analysis	Mar 27, 2023	A191423
D2325324	Certificate of Analysis	Mar 27, 2023	A191423
D2325338	Certificate of Analysis	Mar 27, 2023	A191423
D2325347	Certificate of Analysis	Mar 27, 2023	A191423
D2325329	Certificate of Analysis	Mar 27, 2023	A191423

Chemical and Physical Properties

Molecular Weight	240.570 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	239.991 Da
Monoisotopic Mass	239.991 Da
Topological Polar Surface Area	71.800 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	256.000
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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