2-Bromo-3-nitrothiophene - ≥95% , CAS No.2161-96-8

CAS: 2161-96-8 Cat. No.: D303054 Molecular Weight: 208.03
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
BWMCPPKGEXBKSY-UHFFFAOYSA-N | FT-0712389 | MFCD04037319 | SCHEMBL5841002 | 2-Bromo-3-nitrothiphene | Thiophene, 2-bromo-3-nitro- | AS-30776 | AG-826/25038007 | J-508241 | 2-bromo-3-nitrothiophene | DTXSID80360912 | AKOS016004858
Storage
Room temperature,Desiccated
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
D303054-250mg
3

$9.90

$14.90
Save $5.00 (33.56%)
1g
D303054-1g
4

$23.90

$35.90
Save $12.00 (33.43%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature,Desiccated 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
BWMCPPKGEXBKSY-UHFFFAOYSA-N | FT-0712389 | MFCD04037319 | SCHEMBL5841002 | 2-Bromo-3-nitrothiphene | Thiophene, 2-bromo-3-nitro- | AS-30776 | AG-826/25038007 | J-508241 | 2-bromo-3-nitrothiophene | DTXSID80360912 | AKOS016004858
Specifications & Purity
≥95%
Storage
Room temperature, Desiccated
Shipped In
Normal
Purity
≥95%
Names and Identifiers
Canonical SmilesC1=CSC(=C1[N+](=O)[O-])Br
IUPAC Name2-bromo-3-nitrothiophene
InChIKeyBWMCPPKGEXBKSY-UHFFFAOYSA-N
INCHI1S/C4H2BrNO2S/c5-4-3(6(7)8)1-2-9-4/h1-2H
Isomeric SMILES C1=CSC(=C1[N+](=O)[O-])Br
Molecular Weight 208.03
Reaxy-Rn 122007
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=122007&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
SuperclassOrganoheterocyclic compounds
ClassThiophenes
SubclassNitrothiophenes
Intermediate Tree Nodes Not available
Direct Parent3-nitrothiophenes
Alternative Parents Nitroaromatic compounds  Aryl bromides  Heteroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organonitrogen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 3-nitrothiophene - Nitroaromatic compound - Aryl bromide - Aryl halide - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 3-nitrothiophenes. These are aromatic heterocyclic compound containing a nitro group attached to a thiophene ring a the 3-position.
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.

1 results found

Lot NumberCertificate TypeDateItem
G2306060Certificate of AnalysisMar 05, 2021 D303054
Chemical and Physical Properties
Molecular Weight208.040 g/mol
XLogP32.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass206.899 Da
Monoisotopic Mass206.899 Da
Topological Polar Surface Area74.100 Ų
Heavy Atom Count9
Formal Charge0
Complexity126.000
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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