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4-Bromo-3-trifluoromethoxy-phenylamine - 98%, high purity , CAS No.116369-25-6

COA

Grade & Purity:

≥98%

Cas Number: 116369-25-6
Molecular Weight: 256.02
PubChem CID: 14129198
PubChem SID: 488198599

In stock

Item Number

B166173

Grouped product items
SKU	Size	Availability	Price
B166173-250mg	250mg	4	$63.90
B166173-1g	1g	3	$157.90
B166173-5g	5g	3	$577.90

Basic Description

Synonyms	4-bromo-3-(trifluoromethoxy)aniline \| 116369-25-6 \| 4-Bromo-3-trifluoromethoxy-phenylamine \| Benzenamine, 4-bromo-3-(trifluoromethoxy)- \| SCHEMBL325072 \| DTXSID70556327 \| 4-bromo-3-trifluoromethoxy-aniline \| AMY17614 \| MFCD11506046 \| AKOS015994840 \| PS-7405 \| SB30955 \| 4-Bromo-3
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Aniline and substituted anilines Bromobenzenes Aryl bromides Trihalomethanes Primary amines Organooxygen compounds Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Aniline or substituted anilines - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Trihalomethane - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Primary amine - Halomethane - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a 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	488198599
IUPAC Name	4-bromo-3-(trifluoromethoxy)aniline
INCHI	InChI=1S/C7H5BrF3NO/c8-5-2-1-4(12)3-6(5)13-7(9,10)11/h1-3H,12H2
InChIKey	LFTJNGSZCSGBFU-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1N)OC(F)(F)F)Br
Isomeric SMILES	C1=CC(=C(C=C1N)OC(F)(F)F)Br
UN Number	2810
Packing Group	III
Molecular Weight	256.02
Reaxy-Rn	14338138
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14338138&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
I2221230	Certificate of Analysis	Jul 09, 2025	B166173
I2221164	Certificate of Analysis	Jul 09, 2025	B166173
I2221232	Certificate of Analysis	Jul 09, 2025	B166173

Chemical and Physical Properties

Molecular Weight	256.019 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	254.951 Da
Monoisotopic Mass	254.951 Da
Topological Polar Surface Area	35.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	176.000
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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