4-Bromo-2-fluorobenzoic Acid - ≥98% , CAS No.112704-79-7

CAS: 112704-79-7 Cat. No.: B152368 Molecular Weight: 219.01 EC Number: 630-232-3
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
B1950 | Z106938872 | 4-Bromo-2-fluorobenzoic acid, 97% | ZQQSRVPOAHYHEL-UHFFFAOYSA- | BP-11293 | Benzoic acid, 4-bromo-2-fluoro- | EN300-21728 | 4-bromo-2-fluorobenzenecarboxylic acid | AM20061094 | SCHEMBL156346 | NSC190364 | NSC-190364 | 2-fluro-4-bromo
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
1g
B152368-1g
9
$9.90
5g
B152368-5g
6
$10.90
25g
B152368-25g
3

$13.90

$20.90
Save $7.00 (33.49%)
100g
B152368-100g
8

$48.90

$73.90
Save $25.00 (33.83%)
500g
B152368-500g
1

$243.90

$365.90
Save $122.00 (33.34%)
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

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

Overview

4-Bromo-2-fluorobenzoic acid is a halogen substituted benzoic acid.
4-Bromo-2-fluorobenzoic acid may be used in the synthesis of biaryl intermediates by palladium-mediated coupling with various aryl boronic acids.

Specifications

Synonyms
B1950 | Z106938872 | 4-Bromo-2-fluorobenzoic acid, 97% | ZQQSRVPOAHYHEL-UHFFFAOYSA- | BP-11293 | Benzoic acid, 4-bromo-2-fluoro- | EN300-21728 | 4-bromo-2-fluorobenzenecarboxylic acid | AM20061094 | SCHEMBL156346 | NSC190364 | NSC-190364 | 2-fluro-4-bromo
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488189392
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488189392
Canonical SmilesC1=CC(=C(C=C1Br)F)C(=O)O
IUPAC Name4-bromo-2-fluorobenzoic acid
InChIKeyZQQSRVPOAHYHEL-UHFFFAOYSA-N
INCHI1S/C7H4BrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)
Isomeric SMILES C1=CC(=C(C=C1Br)F)C(=O)O
WGK Germany 3
Molecular Weight 219.01
Reaxy-Rn 6323931
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6323931&ln=

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
ClassBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Halobenzoic acids and derivatives
Direct ParentHalobenzoic acids
Alternative Parents 2-halobenzoic acids  4-halobenzoic acids  Benzoic acids  1-carboxy-2-haloaromatic compounds  Benzoyl derivatives  Bromobenzenes  Fluorobenzenes  Aryl bromides  Aryl fluorides  Vinylogous halides  Monocarboxylic acids and derivatives  Organic oxides  Organobromides  Organooxygen compounds  Organofluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 2-halobenzoic acid or derivatives - Halobenzoic acid - 4-halobenzoic acid - 2-halobenzoic acid - 4-halobenzoic acid or derivatives - Benzoic acid - Benzoyl - 1-carboxy-2-haloaromatic compound - Bromobenzene - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl bromide - Aryl halide - Vinylogous halide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organofluoride - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on 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.

14 results found

Lot NumberCertificate TypeDateItem
C2226060Certificate of AnalysisJan 19, 2026 B152368
C2226067Certificate of AnalysisJan 19, 2026 B152368
C2226069Certificate of AnalysisJan 19, 2026 B152368
C2226242Certificate of AnalysisJan 19, 2026 B152368
C2226244Certificate of AnalysisJan 19, 2026 B152368
D1710071Certificate of AnalysisDec 04, 2024 B152368
G2410575Certificate of AnalysisApr 28, 2024 B152368
D2001169Certificate of AnalysisJan 03, 2024 B152368
I2301039Certificate of AnalysisAug 11, 2023 B152368
I2301040Certificate of AnalysisAug 11, 2023 B152368
I2301041Certificate of AnalysisAug 11, 2023 B152368
I2301042Certificate of AnalysisAug 11, 2023 B152368
C2226412Certificate of AnalysisFeb 23, 2022 B152368
E2330050Certificate of AnalysisFeb 23, 2022 B152368

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Chemical and Physical Properties
SolubilitySolubility in methanol, very faint turbidity.
Melt Point(°C)211-215°C
Molecular Weight219.010 g/mol
XLogP33.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass217.938 Da
Monoisotopic Mass217.938 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count11
Formal Charge0
Complexity163.000
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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