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3,4-Difluorophenylglyoxal hydrate - 95%, high purity , CAS No.79784-34-2

COA

Grade & Purity:

≥95%

Cas Number: 79784-34-2
Molecular Weight: 170.12（anhy）
PubChem CID: 2782289

In stock

Item Number

D186674

Grouped product items
SKU	Size	Availability	Price
D186674-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$23.90
D186674-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$79.90
D186674-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$232.90

Discover 3,4-Difluorophenylglyoxal hydrate by Aladdin Scientific in 95% for only $69.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-(3,4-difluorophenyl)-2-oxoacetaldehyde hydrate \| 2-(3,4-Difluorophenyl)-2-oxoacetaldehyde hydrate(1:x)
Specifications & Purity	≥95%
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 Fluorobenzenes Aryl fluorides Alpha ketoaldehydes Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylacetaldehyde - Benzoyl - Aryl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Alpha-ketoaldehyde - Ketone - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aldehyde - Organofluoride - 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-(3,4-difluorophenyl)-2-oxoacetaldehyde;hydrate
INCHI	InChI=1S/C8H4F2O2.H2O/c9-6-2-1-5(3-7(6)10)8(12)4-11;/h1-4H;1H2
InChIKey	FFYIMFMDGMXVOF-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1C(=O)C=O)F)F.O
Isomeric SMILES	C1=CC(=C(C=C1C(=O)C=O)F)F.O
Alternate CAS	79784-34-2
PubChem CID	2782289
Molecular Weight	170.12（anhy）

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
H2421210	Certificate of Analysis	May 09, 2024	D186674
H2421211	Certificate of Analysis	May 09, 2024	D186674
H2421213	Certificate of Analysis	May 09, 2024	D186674
H2421221	Certificate of Analysis	May 09, 2024	D186674
H2421222	Certificate of Analysis	May 09, 2024	D186674
H2421212	Certificate of Analysis	May 09, 2024	D186674

Chemical and Physical Properties

Melt Point(°C)	85°C - 90°C
Molecular Weight	188.130 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	188.029 Da
Monoisotopic Mass	188.029 Da
Topological Polar Surface Area	35.100 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193.000
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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