2,3,4,5,6-Pentabromoaniline - ≥97% , CAS No.13665-98-0

CAS: 13665-98-0 Cat. No.: P167096 Molecular Weight: 487.61 EC Number: 659-490-5 PubChem CID: 3014769
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
2,3,4,5,6-pentabromoaniline|13665-98-0|Benzenamine, 2,3,4,5,6-pentabromo-|Pentabrom-anilin|Aniline, 2,3,4,5,6-pentabromo-|2,3,4,5,6-Pentabromobenzenamine|SARCOSINEHYDROCHLORIDE|SCHEMBL3739006|DTXSID90159879|AKOS016007376|CS-0445533|FT-0636934
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
P167096-50mg
4
$158.90
250mg
P167096-250mg
4
$331.90
1g
P167096-1g
4
$1,029.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥97% 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

2,3,4,5,6-Pentabromoaniline is used as a reagent to synthesize polybrominated phenyls, compounds that act as fire retardants.

Specifications

Synonyms
2, 3, 4, 5, 6-pentabromoaniline | 13665-98-0 | Benzenamine, 2, 3, 4, 5, 6-pentabromo- | Pentabrom-anilin | Aniline, 2, 3, 4, 5, 6-pentabromo- | 2, 3, 4, 5, 6-Pentabromobenzenamine | SARCOSINEHYDROCHLORIDE | SCHEMBL3739006 | DTXSID90159879 | AKOS016007376 | CS-0445533 | FT-0636934
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid488194150
Canonical SmilesC1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)N
IUPAC Name2,3,4,5,6-pentabromoaniline
InChIKeyVPFMJGCHDCVATR-UHFFFAOYSA-N
INCHI1S/C6H2Br5N/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H2
Isomeric SMILES C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)N
PubChem CID 3014769
Molecular Weight 487.61

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
SubclassAniline and substituted anilines
Intermediate Tree Nodes Not available
Direct Parent2-bromoanilines
Alternative Parents Bromobenzenes  Aryl bromides  Primary amines  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 2-bromoaniline - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 2-bromoanilines. These are organic compounds that contain an aniline carrying a bromine atom at the C2-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.

4 results found

Lot NumberCertificate TypeDateItem
B2323019Certificate of AnalysisDec 22, 2025 P167096
B23221203Certificate of AnalysisDec 22, 2025 P167096
B23221202Certificate of AnalysisDec 10, 2025 P167096
C2528285Certificate of AnalysisNov 23, 2022 P167096
Chemical and Physical Properties
Molecular Weight487.610 g/mol
XLogP34.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass486.606 Da
Monoisotopic Mass482.61 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count12
Formal Charge0
Complexity150.000
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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