Skip to the beginning of the images gallery

5-(4-Bromophenyl)oxazole-2-propionic acid - 97%, high purity , CAS No.23464-96-2

COA

Grade & Purity:

≥97%

Cas Number: 23464-96-2
Molecular Weight: 296.12
MDL number: MFCD07784410
PubChem CID: 16044718
PubChem SID: 488199023

In stock

Item Number

B168859

Grouped product items
SKU	Size	Availability	Price
B168859-250mg	250mg	2	$13.90
B168859-1g	1g	1	$41.90
B168859-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$186.90

Basic Description

Synonyms	2-Oxazolepropanoic acid, 5-(4-bromophenyl)- \| 5-(4-Bromophenyl)oxazole-2-propionic acid \| AR-683/43306484 \| MFCD07784410 \| TS-01075 \| 3-(5-(4-Bromophenyl)oxazol-2-yl)propanoicacid \| 3-[5-(4-bromophenyl)-1,3-oxazol-2-yl]propanoic acid \| 3-[5-(4-BROMOPHENYL
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Oxazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Oxazoles
Intermediate Tree Nodes	Not available
Direct Parent	Phenyl-1,3-oxazoles
Alternative Parents	Bromobenzenes 2,5-disubstituted oxazoles Aryl bromides Heteroaromatic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenyl-1,3-oxazole - 2,5-disubstituted 1,3-oxazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.
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	488199023
IUPAC Name	3-[5-(4-bromophenyl)-1,3-oxazol-2-yl]propanoic acid
INCHI	InChI=1S/C12H10BrNO3/c13-9-3-1-8(2-4-9)10-7-14-11(17-10)5-6-12(15)16/h1-4,7H,5-6H2,(H,15,16)
InChIKey	JLFDJAGKPSZXGN-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1C2=CN=C(O2)CCC(=O)O)Br
Isomeric SMILES	C1=CC(=CC=C1C2=CN=C(O2)CCC(=O)O)Br
WGK Germany	3
Molecular Weight	296.12
Reaxy-Rn	1079270
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1079270&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.

5 results found

Lot Number	Certificate Type	Date	Item
E2329670	Certificate of Analysis	Jun 07, 2023	B168859
E2327887	Certificate of Analysis	Jun 07, 2023	B168859
E2327875	Certificate of Analysis	Jun 06, 2023	B168859
E2327880	Certificate of Analysis	Jun 06, 2023	B168859
E2327882	Certificate of Analysis	Jun 06, 2023	B168859

Chemical and Physical Properties

Melt Point(°C)	160-164 °C
Molecular Weight	296.120 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	294.984 Da
Monoisotopic Mass	294.984 Da
Topological Polar Surface Area	63.300 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	266.000
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

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration