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4-Bromo-2-(trifluoromethoxy)benzaldehyde - 98%, high purity , CAS No.220996-80-5

COA

Grade & Purity:

≥98%

Cas Number: 220996-80-5
Molecular Weight: 269
PubChem CID: 18700087
PubChem SID: 504768763

In stock

Item Number

B182896

Grouped product items
SKU	Size	Availability	Price
B182896-1g	1g	3	$18.90
B182896-5g	5g	3	$67.90
B182896-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$223.90
B182896-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$642.90

Basic Description

Synonyms	4-Bromo-2-(trifluoromethoxy)benzaldehyde \| 220996-80-5 \| 4-bromo-2-trifluoromethoxy-benzaldehyde \| 4-Bromo-2-trifluoromethoxybenzaldehyde \| MFCD12406886 \| Benzaldehyde, 4-bromo-2-(trifluoromethoxy)- \| 4-bromo-2-(trifluoro-methoxy)benzaldehyde \| 4-bromo-2-[(trifluoromet
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 Benzoyl derivatives Benzaldehydes Bromobenzenes Aryl bromides Trihalomethanes Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Benzaldehyde - Benzoyl - Phenol ether - Bromobenzene - Halobenzene - Aryl-aldehyde - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Trihalomethane - Organobromide - Organohalogen compound - Halomethane - Organic oxide - Alkyl halide - Organic oxygen compound - Alkyl fluoride - Aldehyde - Organofluoride - Organooxygen compound - 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	504768763
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504768763
IUPAC Name	4-bromo-2-(trifluoromethoxy)benzaldehyde
INCHI	InChI=1S/C8H4BrF3O2/c9-6-2-1-5(4-13)7(3-6)14-8(10,11)12/h1-4H
InChIKey	AXZVKHIUQLEMPJ-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1Br)OC(F)(F)F)C=O
Isomeric SMILES	C1=CC(=C(C=C1Br)OC(F)(F)F)C=O
Molecular Weight	269
Reaxy-Rn	8255680
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8255680&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot Number	Certificate Type	Date	Item
J1918092	Certificate of Analysis	May 12, 2025	B182896
F2301394	Certificate of Analysis	Dec 23, 2022	B182896
L22071246	Certificate of Analysis	Dec 23, 2022	B182896
F2301396	Certificate of Analysis	Aug 10, 2022	B182896

Chemical and Physical Properties

Molecular Weight	269.010 g/mol
XLogP3	3.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	267.935 Da
Monoisotopic Mass	267.935 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	207.000
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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