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4-Bromophenylglyoxal hydrate - 96%, high purity , CAS No.80352-42-7

COA

Grade & Purity:

≥96%

Cas Number: 80352-42-7
Molecular Weight: 231
PubChem CID: 12329346

In stock

Item Number

B186695

Grouped product items
SKU	Size	Availability	Price
B186695-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90
B186695-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$189.90
B186695-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$787.90

Discover 4-Bromophenylglyoxal hydrate by Aladdin Scientific in 96% for only $45.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	MFCD09260478 \| AMY3719 \| 4-bromophenylglyoxal hydrate \| p-bromophenylglyoxal hydrate \| 4-Bromophenyl glyoxal hydrate \| A863371 \| A19746 \| 2-(4-bromophenyl)-2-oxoacetaldehyde hydrate \| AB49987 \| AKOS015855152 \| 2-(4-Bromophenyl)-2-oxoacetaldehyde,hydrate \|
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylacetaldehydes
Intermediate Tree Nodes	Not available
Direct Parent	Phenylacetaldehydes
Alternative Parents	Benzoyl derivatives Aryl ketones Bromobenzenes Aryl bromides Alpha ketoaldehydes Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylacetaldehyde - Benzoyl - Aryl ketone - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Alpha-ketoaldehyde - Ketone - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aldehyde - Organobromide - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylacetaldehydes. These are compounds containing a phenylacetaldehyde moiety, which consists of a phenyl group substituted at the second position by an acetalydehyde.
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-(4-bromophenyl)-2-oxoacetaldehyde;hydrate
INCHI	InChI=1S/C8H5BrO2.H2O/c9-7-3-1-6(2-4-7)8(11)5-10;/h1-5H;1H2
InChIKey	IOONPDHKLYFDML-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1C(=O)C=O)Br.O
Isomeric SMILES	C1=CC(=CC=C1C(=O)C=O)Br.O
PubChem CID	12329346
Molecular Weight	231

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	231.040 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	229.958 Da
Monoisotopic Mass	229.958 Da
Topological Polar Surface Area	35.100 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	159.000
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	2

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