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3-Chloro-4-fluorophenol - 98%, high purity , CAS No.2613-23-2

COA

Grade & Purity:

≥98%

Cas Number: 2613-23-2
Molecular Weight: 146.55
Beilstein Registry Number: 3236443
EC Number: 220-042-5
MDL number: MFCD00002257
PubChem CID: 75790
PubChem SID: 504754992

In stock

Item Number

C120812

Grouped product items
SKU	Size	Availability	Price
C120812-5g	5g	5	$27.90
C120812-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
C120812-25g	25g	3	$110.90
C120812-100g	100g	3	$397.90
C120812-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,788.90

View related series

Non heterocyclic fluorine-containing block (1408) Oxygenated compounds (806)

Basic Description

Synonyms	AKOS000119338 \| MFCD00002257 \| 3-chloro-4-luorophenol \| EINECS 220-042-5 \| FT-0615395 \| Z104477690 \| InChI=1/C6H4ClFO/c7-5-3-4(9)1-2-6(5)8/h1-3,9 \| 3-Chloro-4-fluorophenol \| 3-chloro-4-fluoro-phenol \| 3-chloro4-fluorophenol \| AM61417 \| 3-Chloro-4-fluoroph
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C
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 Phenols
    - Subclass Halophenols
      - Level5 Fluorophenols
        Level6 P-fluorophenols

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	Halophenols
Intermediate Tree Nodes	Fluorophenols
Direct Parent	P-fluorophenols
Alternative Parents	M-chlorophenols Fluorobenzenes Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Aryl chlorides Organooxygen compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	4-fluorophenol - 3-chlorophenol - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as p-fluorophenols. These are fluorophenols carrying a iodine at the C4 position of the benzene ring.
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	504754992
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754992
IUPAC Name	3-chloro-4-fluorophenol
INCHI	InChI=1S/C6H4ClFO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H
InChIKey	ZQXLIXHVJVAPLW-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1O)Cl)F
Isomeric SMILES	C1=CC(=C(C=C1O)Cl)F
WGK Germany	3
Molecular Weight	146.55
Beilstein	3236443
Reaxy-Rn	3236443
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3236443&ln=

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
F2222326	Certificate of Analysis	Mar 20, 2024	C120812
F2222267	Certificate of Analysis	Mar 20, 2024	C120812
F2222335	Certificate of Analysis	Mar 20, 2024	C120812
F2222333	Certificate of Analysis	Mar 20, 2024	C120812
A2205062	Certificate of Analysis	Oct 19, 2023	C120812
C1328076	Certificate of Analysis	Aug 05, 2022	C120812

Chemical and Physical Properties

Flash Point(°F)	228.2 °F
Flash Point(°C)	108°(226°F)
Boil Point(°C)	103-104°C/11mmHg
Melt Point(°C)	38-43°C
Molecular Weight	146.540 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	145.993 Da
Monoisotopic Mass	145.993 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	99.100
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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