2,5-Dibromoadipic Acid Diethyl Ester - ≥98% , CAS No.869-10-3

CAS: 869-10-3 Cat. No.: D139355 Molecular Weight: 360.04 EC Number: 629-459-0
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
BCP17029 | DTXSID20969201 | STL367872 | VS-08146 | UBCNJHBDCUBIPB-UHFFFAOYSA-N | diethyl2,5-dibromohexanedioate | Hexanedioic acid, 2,5-dibromo-, diethyl ester | A841876 | AKOS016842434 | NCGC00325909-01 | AMY1635 | FT-0624845 | NSC143938 | NSC-143938 | 2
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
D139355-5g
2

$9.90

$14.90
Save $5.00 (33.56%)
25g
D139355-25g
2

$18.90

$28.90
Save $10.00 (34.60%)
100g
D139355-100g
2

$40.90

$61.90
Save $21.00 (33.93%)
500g
D139355-500g
1

$173.90

$260.90
Save $87.00 (33.35%)
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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

Diethyl meso-2,5-dibromoadipate reacts with N-methylallylamine in the presence of potassium carbonate to yield two diastereomers of diethyl 2-allyl-N-methylpyrrolidine-2,5-dicarboxylate.
Diethyl meso-2,5-dibromoadipate may be employed as difunctional initiator during n-butyl acrylate (n-BuA) polymerization, leading to α,ω-bromo-poly(n-BuA) having narrow molecular weight distribution.

Specifications

Synonyms
BCP17029 | DTXSID20969201 | STL367872 | VS-08146 | UBCNJHBDCUBIPB-UHFFFAOYSA-N | diethyl2, 5-dibromohexanedioate | Hexanedioic acid, 2, 5-dibromo-, diethyl ester | A841876 | AKOS016842434 | NCGC00325909-01 | AMY1635 | FT-0624845 | NSC143938 | NSC-143938 | 2
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Canonical SmilesCCOC(=O)C(CCC(C(=O)OCC)Br)Br
IUPAC Namediethyl 2,5-dibromohexanedioate
InChIKeyUBCNJHBDCUBIPB-UHFFFAOYSA-N
INCHI1S/C10H16Br2O4/c1-3-15-9(13)7(11)5-6-8(12)10(14)16-4-2/h7-8H,3-6H2,1-2H3
Isomeric SMILES CCOC(=O)C(CCC(C(=O)OCC)Br)Br
WGK Germany 3
UN Number 3261
Packing Group II
Molecular Weight 360.04
Reaxy-Rn 1727847
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1727847&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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
ClassFatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Dicarboxylic acids and derivatives  Alpha-halocarboxylic acid derivatives  Carboxylic acid esters  Organobromides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl bromides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Dicarboxylic acid or derivatives - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
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
B2215243Certificate of AnalysisSep 09, 2025 D139355
B2215253Certificate of AnalysisSep 09, 2025 D139355
B2215750Certificate of AnalysisSep 09, 2025 D139355
E1702027Certificate of AnalysisDec 06, 2022 D139355
Chemical and Physical Properties
SolubilitySoluble in Methanol
SensitivityLight Sensitive
Boil Point(°C)134 °C/0.5 mmHg
Melt Point(°C)66 °C
Molecular Weight360.040 g/mol
XLogP33.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass359.939 Da
Monoisotopic Mass357.942 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count16
Formal Charge0
Complexity209.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
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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