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2-Chloro-3-fluorobenzaldehyde - 97%, high purity , CAS No.96516-31-3

COA

Grade & Purity:

≥97%

Cas Number: 96516-31-3
Molecular Weight: 158.56
MDL number: MFCD07782053
PubChem CID: 14944905

In stock

Item Number

C124145

Grouped product items
SKU	Size	Availability	Price
C124145-250mg	250mg	2	$9.90
C124145-1g	1g	2	$11.90
C124145-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$28.90
C124145-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$100.90

Basic Description

Synonyms	2-Chloro-3-fluorobenzaldehyde \| 96516-31-3 \| C7H4ClFO \| Benzaldehyde, 2-chloro-3-fluoro- \| MFCD07782053 \| 2-Chloro-3-fluoro-benzaldehyde \| starbld0008954 \| 2-chlorofluorobenzaldehyde \| SCHEMBL561472 \| DTXSID00565846 \| PIZVRLVKXWEMGO-UHFFFAOYSA-N \| CL8262 \| AKOS005063859 \| AC-2298 \|
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

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 Fluorobenzenes Chlorobenzenes Aryl fluorides Aryl chlorides Vinylogous halides Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzaldehyde - Benzoyl - Chlorobenzene - Fluorobenzene - Aryl-aldehyde - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Vinylogous halide - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aldehyde - Organohalogen compound - Organochloride - Organofluoride - 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-chloro-3-fluorobenzaldehyde
INCHI	InChI=1S/C7H4ClFO/c8-7-5(4-10)2-1-3-6(7)9/h1-4H
InChIKey	PIZVRLVKXWEMGO-UHFFFAOYSA-N
Smiles	C1=CC(=C(C(=C1)F)Cl)C=O
Isomeric SMILES	C1=CC(=C(C(=C1)F)Cl)C=O
Molecular Weight	158.56
Reaxy-Rn	5861248
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5861248&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.

3 results found

Lot Number	Certificate Type	Date	Item
G1528043	Certificate of Analysis	Aug 04, 2023	C124145
F2224359	Certificate of Analysis	Jun 27, 2022	C124145
F2224360	Certificate of Analysis	Jun 27, 2022	C124145

Chemical and Physical Properties

Sensitivity	Air Sensitive
Melt Point(°C)	29-32℃
Molecular Weight	158.560 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	157.993 Da
Monoisotopic Mass	157.993 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129.000
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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