2-Bromo-2′-nitroacetophenone - ≥98% , CAS No.6851-99-6

CAS: 6851-99-6 Cat. No.: B122558 Formula: C8H6BrNO3 Molecular Weight: 244.04 Beilstein Registry Number: 7(3)998 EC Number: 628-789-2
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
Ethanone, 2-bromo-1-(2-nitrophenyl)- | 2-Bromo-1-(2-nitrophenyl)ethanone | 2-Bromo-1-(2-nitro-phenyl)-ethanone | EN300-26140949 | AT-419/43492654 | Bromo-2'-nitroacetophenone | A9120 | AKOS004904847 | AM20041011 | B3528 | J-508190 | SCHEMBL220347 | DTXSID
Storage
Room temperature
Shipped In
Normal
★
Size
Germany (EU)
USA*
Price
Qty
1g
B122558-1g
—
3 In stock

€9.46

€14.66
Save €5.21 (35.50%)
5g
B122558-5g
—
1 In stock

€18.14

€27.68
Save €9.55 (34.48%)
25g
B122558-25g
—
2 In stock

€43.30

€64.99
Save €21.69 (33.38%)
100g
B122558-100g
—
1 In stock

€169.12

€254.16
Save €85.04 (33.46%)
Enter a quantity for the sizes you want to add.
🧪

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.

Overview

Application

2-Bromo-2′-nitroacetophenone, an electroactive derivative-forming reagent, was used as a precolumn reagent for preparing prostaglandin derivatives.

Specifications

Synonyms
Ethanone, 2-bromo-1-(2-nitrophenyl)- | 2-Bromo-1-(2-nitrophenyl)ethanone | 2-Bromo-1-(2-nitro-phenyl)-ethanone | EN300-26140949 | AT-419/43492654 | Bromo-2'-nitroacetophenone | A9120 | AKOS004904847 | AM20041011 | B3528 | J-508190 | SCHEMBL220347 | DTXSID
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid508808294
Canonical SmilesC1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-]
IUPAC Name2-bromo-1-(2-nitrophenyl)ethanone
InChIKeySGXUUCSRVVSMGK-UHFFFAOYSA-N
INCHI1S/C8H6BrNO3/c9-5-8(11)6-3-1-2-4-7(6)10(12)13/h1-4H,5H2
Isomeric SMILES C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-]
WGK Germany 3
UN Number 3261
Molecular Weight 244.04
Beilstein 7(3)998
Reaxy-Rn 881089
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=881089&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
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Nitrobenzenes  Nitroaromatic compounds  Benzoyl derivatives  Aryl alkyl ketones  Alpha-haloketones  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organonitrogen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Alkyl-phenylketone - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Alkyl bromide - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Alkyl halide - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
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.

6 results found

Lot NumberCertificate TypeDateItem
I2622028Certificate of AnalysisSep 29, 2026 B122558
G2227738Certificate of AnalysisFeb 04, 2026 B122558
G2227739Certificate of AnalysisFeb 04, 2026 B122558
G2227740Certificate of AnalysisFeb 04, 2026 B122558
L2314053Certificate of AnalysisSep 09, 2025 B122558
E1420045Certificate of AnalysisFeb 22, 2022 B122558
Chemical and Physical Properties
SolubilityInsoluble in water; Soluble in Methanol
Melt Point(°C)55-57°C
Molecular Weight244.040 g/mol
XLogP32.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass242.953 Da
Monoisotopic Mass242.953 Da
Topological Polar Surface Area62.900 Ų
Heavy Atom Count13
Formal Charge0
Complexity214.000
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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