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2-Bromo-4-(trifluoromethyl)benzaldehyde - 98%, high purity , CAS No.85118-24-7

COA

Grade & Purity:

≥98%

Cas Number: 85118-24-7
Molecular Weight: 253
PubChem CID: 3020373

In stock

Item Number

B187100

Grouped product items
SKU	Size	Availability	Price
B187100-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$59.90
B187100-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$199.90
B187100-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$687.90
B187100-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,923.90

Discover 2-Bromo-4-(trifluoromethyl)benzaldehyde by Aladdin Scientific in 98% for only $59.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Bromo-4-(trifluoromethyl)benzaldehyde \| 85118-24-7 \| Benzaldehyde, 2-bromo-4-(trifluoromethyl)- \| MFCD09835101 \| N94F74WA95 \| EINECS 285-677-2 \| SCHEMBL153259 \| UNII-N94F74WA95 \| DTXSID00234247 \| AMY23060 \| CL9118 \| AKOS005063847 \| 2-Bromo-4-trifluoromethyl-benzaldehyde \| CS-W00
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 Trifluoromethylbenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Trifluoromethylbenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Trifluoromethylbenzenes
Alternative Parents	Benzoyl derivatives Benzaldehydes Bromobenzenes Aryl bromides Vinylogous halides Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Trifluoromethylbenzene - Benzaldehyde - Benzoyl - Aryl-aldehyde - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous halide - Organohalogen compound - Organofluoride - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organobromide - 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

IUPAC Name	2-bromo-4-(trifluoromethyl)benzaldehyde
INCHI	InChI=1S/C8H4BrF3O/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-4H
InChIKey	CUKSTNNYAHZPRM-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1C(F)(F)F)Br)C=O
Isomeric SMILES	C1=CC(=C(C=C1C(F)(F)F)Br)C=O
Molecular Weight	253
Reaxy-Rn	5518185
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5518185&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	253.020 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	251.94 Da
Monoisotopic Mass	251.94 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	192.000
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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