3-Bromobenzamide - ≥98% , CAS No.22726-00-7

CAS: 22726-00-7 Cat. No.: B152344 Formula: C7H6BrNO Molecular Weight: 200.04 EC Number: 607-149-6
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
Q27893908 | SCHEMBL163949 | 3-bromophenylcarboxamide | AC-907/41484593 | Benzamide, m-bromo- | FT-0615195 | BDBM50106197 | Butyric acid, 3-amino-4-hydroxy-, (-)- | ODJFDWIECLJWSR-UHFFFAOYSA-N | SY020170 | Benzamide, 3-bromo- | A816327 | 694N917Z7T | NSC 8
Storage
Room temperature
Shipped In
Normal
Size
Germany (EU)
USA*
Price
Qty
5g
B152344-5g
4 In stock

€8.59

€12.93
Save €4.34 (33.56%)
10g
B152344-10g
8 In stock

€9.46

€14.66
Save €5.21 (35.50%)
25g
B152344-25g
5 In stock

€20.74

€31.15
Save €10.41 (33.43%)
100g
B152344-100g
4 In stock

€71.94

€108.38
Save €36.45 (33.63%)
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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
Q27893908 | SCHEMBL163949 | 3-bromophenylcarboxamide | AC-907/41484593 | Benzamide, m-bromo- | FT-0615195 | BDBM50106197 | Butyric acid, 3-amino-4-hydroxy-, (-)- | ODJFDWIECLJWSR-UHFFFAOYSA-N | SY020170 | Benzamide, 3-bromo- | A816327 | 694N917Z7T | NSC 8
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488186570
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186570
Canonical SmilesC1=CC(=CC(=C1)Br)C(=O)N
IUPAC Name3-bromobenzamide
InChIKeyODJFDWIECLJWSR-UHFFFAOYSA-N
INCHI1S/C7H6BrNO/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H2,9,10)
Isomeric SMILES C1=CC(=CC(=C1)Br)C(=O)N
Molecular Weight 200.04
Reaxy-Rn 1860187
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1860187&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 Parent3-halobenzoic acids and derivatives
Alternative Parents Benzamides  Benzoyl derivatives  Bromobenzenes  Aryl bromides  Primary carboxylic acid amides  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 3-halobenzoic acid or derivatives - Benzamide - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
PARP1 Tclin Poly [ADP-ribose] polymerase-1 (6206 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
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
H2205693Certificate of AnalysisMay 18, 2026 B152344
H2205694Certificate of AnalysisMay 18, 2026 B152344
H2205698Certificate of AnalysisMay 18, 2026 B152344
H2205699Certificate of AnalysisMay 18, 2026 B152344
Chemical and Physical Properties
x_melt_point_char158 °C
Molecular Weight200.030 g/mol
XLogP31.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass198.963 Da
Monoisotopic Mass198.963 Da
Topological Polar Surface Area43.100 Ų
Heavy Atom Count10
Formal Charge0
Complexity138.000
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
Reviews

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