2-Bromoethyl Benzoate - ≥98%(GC) , CAS No.939-54-8

CAS: 939-54-8 Cat. No.: B152726 Summenformel: C9H9BrO2 Molekulargewicht: 229.07 EG-Nummer: 628-389-8
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GRADE & PURITY ≥98%(GC)
Synonyms
BS-22296 | InChI=1/C9H9BrO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2 | SCHEMBL561869 | DTXSID30335150 | 2-Bromoethyl benzoate | 2-Bromoethyl benzoate, 98% | KNBBDZULQFKSIE-UHFFFAOYSA- | FT-0647417 | SY052379 | AKOS005203196 | B0065 | Bromoethyl Benzoate
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
5g
B152726-5g
—
2 Auf Lager

54,58€

82,35€
Speichern 27,77 € (33.72%)
25g
B152726-25g
—
2 Auf Lager

168,25€

252,43€
Speichern 84,17 € (33.34%)
100g
B152726-100g
—
2 Auf Lager

554,40€

832,07€
Speichern 277,68 € (33.37%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) 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.

Übersicht

2-Bromoethyl benzoate is an ester.

Specifications

Synonyme
BS-22296 | InChI=1/C9H9BrO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2 | SCHEMBL561869 | DTXSID30335150 | 2-Bromoethyl benzoate | 2-Bromoethyl benzoate, 98% | KNBBDZULQFKSIE-UHFFFAOYSA- | FT-0647417 | SY052379 | AKOS005203196 | B0065 | Bromoethyl Benzoate
Spezifikationen & Reinheit
≥98%(GC)
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥98%(GC)
Namen und Kennungen
Pubchem Sid
Kanonisches Lächeln
C1=CC=C(C=C1)C(=O)OCCBr
IUPAC Name
2-bromoethyl benzoate
InChIKey
KNBBDZULQFKSIE-UHFFFAOYSA-N
INCHI
1S/C9H9BrO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
Isomere SMILES
C1=CC=C(C=C1)C(=O)OCCBr
WGK Deutschland
3
Molekulargewicht
229.07
Reaxy-Rn
638537
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=638537&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
KlasseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentBenzoic acid esters
Alternative Parents Benzoyl derivatives  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organooxygen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzoate ester - Benzoyl - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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 TypeDatumArtikel
L2313078Certificate of AnalysisSep 10, 2025 B152726
L2313079Certificate of AnalysisSep 10, 2025 B152726
L2313080Certificate of AnalysisSep 10, 2025 B152726
L2313081Certificate of AnalysisSep 10, 2025 B152726
L2313082Certificate of AnalysisSep 10, 2025 B152726
L2313429Certificate of AnalysisSep 10, 2025 B152726
Chemische und physikalische Eigenschaften
Brechungsindex1.55
Flammpunkt (°F)235.4 °F
Flammpunkt (°C)113 °C
Siedepunkt (°C)285°C(lit.)
Molekulargewicht229.070 g/mol
XLogP32.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass227.979 Da
Monoisotopic Mass227.979 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity141.000
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
Lösungsrechner
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