4-Bromotetrafluorophenol - ≥96% , CAS No.1998-61-4

CAS: 1998-61-4 Cat. No.: B701166 Molecular Weight: 244.98 EC Number: 674-536-4 PubChem CID: 2783331
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
4-Bromo-2,3,5,6-tetrafluorophenol
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
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Size
Status
Price
Qty
250mg
B701166-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$9.90
1g
B701166-1g
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$20.90
5g
B701166-5g
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$62.90

$64.90
Save $2.00 (3.08%)
25g
B701166-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$256.90

$259.90
Save $3.00 (1.15%)
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Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
4-Bromo-2, 3, 5, 6-tetrafluorophenol
Specifications & Purity
≥96%
Storage
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.
Purity
≥96%
Names and Identifiers
Canonical SmilesC1(=C(C(=C(C(=C1F)F)Br)F)F)O
IUPAC Name4-bromo-2,3,5,6-tetrafluorophenol
InChIKeyZBYSEVWUBQSGKC-UHFFFAOYSA-N
INCHI1S/C6HBrF4O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
Isomeric SMILES C1(=C(C(=C(C(=C1F)F)Br)F)F)O
PubChem CID 2783331
Molecular Weight 244.98

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassPhenols
SubclassHalophenols
Intermediate Tree Nodes Bromophenols
Direct ParentP-bromophenols
Alternative Parents O-fluorophenols  M-fluorophenols  Fluorobenzenes  Bromobenzenes  Aryl fluorides  Aryl bromides  Organooxygen compounds  Organofluorides  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 4-bromophenol - 3-fluorophenol - 2-fluorophenol - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as p-bromophenols. These are bromophenols carrying a iodine at the C4 position of the benzene ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





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.

4 results found

Lot NumberCertificate TypeDateItem
L2525332Certificate of AnalysisNov 03, 2025 B701166
L2525333Certificate of AnalysisNov 03, 2025 B701166
L2525334Certificate of AnalysisNov 03, 2025 B701166
L2525335Certificate of AnalysisNov 03, 2025 B701166
Chemical and Physical Properties
Boil Point(°C)76-77°/4mm
Melt Point(°C)38-39°
Molecular Weight244.970 g/mol
XLogP33.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass243.915 Da
Monoisotopic Mass243.915 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count12
Formal Charge0
Complexity154.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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