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2，4-Difluoro-3-methylbenzaldehyde - ≥97%, high purity , CAS No.847502-88-9

COA

Grade & Purity:

≥97%

Cas Number: 847502-88-9
Molecular Weight: 156.13
PubChem CID: 12137489

In stock

Item Number

D726494

Grouped product items
SKU	Size	Availability	Price	Qty
D726494-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$62.90
D726494-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$234.90

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Aromatic Ring Compounds (348) Molecular block (319)

Basic Description

Synonyms	2,4-Difluoro-m-tolualdehyde
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Argon charged

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoyl derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzoyl derivatives
Alternative Parents	Benzaldehydes Toluenes Fluorobenzenes Aryl fluorides Vinylogous halides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzaldehyde - Benzoyl - Fluorobenzene - Halobenzene - Toluene - Aryl-aldehyde - Aryl fluoride - Aryl halide - Vinylogous halide - Organooxygen compound - Organofluoride - Organohalogen compound - Aldehyde - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
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-difluoro-3-methylbenzaldehyde
INCHI	InChI=1S/C8H6F2O/c1-5-7(9)3-2-6(4-11)8(5)10/h2-4H,1H3
InChIKey	MPOSIFXAXWZQED-UHFFFAOYSA-N
Smiles	CC1=C(C=CC(=C1F)C=O)F
Isomeric SMILES	CC1=C(C=CC(=C1F)C=O)F
PubChem CID	12137489
Molecular Weight	156.13

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

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

Analytical Chart:

Chemical and Physical Properties

Sensitivity	Moisture sensitive
Molecular Weight	156.130 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	156.039 Da
Monoisotopic Mass	156.039 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	149.000
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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