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3-Bromo-4-fluorophenol - 98%, high purity , CAS No.27407-11-0

COA

Grade & Purity:

≥98%

Cas Number: 27407-11-0
Molecular Weight: 191
MDL number: MFCD03425884
PubChem CID: 2783381
PubChem SID: 504762129

In stock

Item Number

B137152

Grouped product items
SKU	Size	Availability	Price
B137152-1g	1g	3	$9.90
B137152-5g	5g	3	$32.90
B137152-25g	25g	3	$111.90
B137152-100g	100g	2	$400.90

View related series

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

Basic Description

Synonyms	3-Bromo-4-Fluorophenol \| 3-bromo-4-fluoro-phenol \| Phenol, 3-bromo-4-fluoro- \| SY002949 \| AC-3757 \| FT-0601361 \| PS-8370 \| CL8474 \| AKOS006230023 \| BCP26659 \| SCHEMBL189322 \| A1620 \| A819049 \| DTXSID70382623 \| EN300-118525 \| 3-bromanyl-4-fluoranyl-phenol
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal

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-bromophenols Fluorobenzenes Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Aryl bromides Organooxygen compounds Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	4-fluorophenol - 3-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organobromide - 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	504762129
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504762129
IUPAC Name	3-bromo-4-fluorophenol
INCHI	InChI=1S/C6H4BrFO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H
InChIKey	QWTULQLVGNZMLF-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1O)Br)F
Isomeric SMILES	C1=CC(=C(C=C1O)Br)F
Molecular Weight	191
Reaxy-Rn	2042872
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042872&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
K2216212	Certificate of Analysis	Aug 23, 2024	B137152
K2216208	Certificate of Analysis	Aug 23, 2024	B137152
D2416213	Certificate of Analysis	Mar 20, 2024	B137152
D2416214	Certificate of Analysis	Mar 20, 2024	B137152
E1527005	Certificate of Analysis	Dec 07, 2022	B137152

Chemical and Physical Properties

Solubility	Soluble in Methanol
Sensitivity	Hygroscopic
Boil Point(°C)	78°C/0.5mmHg
Molecular Weight	191.000 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	189.943 Da
Monoisotopic Mass	189.943 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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