Methyl 3,5-dibromo-2-hydroxybenzoate - ≥97% , CAS No.21702-79-4

CAS: 21702-79-4 Cat. No.: M698516 Peso molecular: 309.95 Número EC: 606-824-2
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
Benzoic acid, 3,5-dibromo-2-hydroxy-, methyl ester
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
Size
Estado
Price
Qty
1g
M698516-1g
1

9,90US$

14,90US$
Guardar 5,00 US$ (33.56%)
5g
M698516-5g
1

27,90US$

41,90US$
Guardar 14,00 US$ (33.41%)
25g
M698516-25g
1

109,90US$

164,90US$
Guardar 55,00 US$ (33.35%)
100g
M698516-100g
1

349,90US$

524,90US$
Guardar 175,00 US$ (33.34%)
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

Store at 2-8°C,Argon charged Ships Wet ice 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

Sinónimos
Benzoic acid, 3, 5-dibromo-2-hydroxy-, methyl ester
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Argon charged
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥97%
Nombres e identificadores
Pubchem Sid528759321
Sonrisas canónicasCOC(=O)C1=C(C(=CC(=C1)Br)Br)O
IUPAC Namemethyl 3,5-dibromo-2-hydroxybenzoate
InChIKeyKISQISIKTRRMOX-UHFFFAOYSA-N
INCHI1S/C8H6Br2O3/c1-13-8(12)5-2-4(9)3-6(10)7(5)11/h2-3,11H,1H3
Isómeros SMILES COC(=O)C1=C(C(=CC(=C1)Br)Br)O
Peso molecular 309.95

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
ClaseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Benzoic acid esters
Direct Parento-Hydroxybenzoic acid esters
Alternative Parents Salicylic acid and derivatives  3-halobenzoic acids and derivatives  P-bromophenols  O-bromophenols  Benzoyl derivatives  Bromobenzenes  Aryl bromides  Vinylogous acids  Methyl esters  Monocarboxylic acids and derivatives  Organooxygen compounds  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents O-hydroxybenzoic acid ester - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Salicylic acid or derivatives - Benzoyl - 4-bromophenol - 4-halophenol - 2-bromophenol - 2-halophenol - Phenol - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous acid - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organohalogen compound - Organobromide - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

8 results found

Lot NumberCertificate TypeFechaArticulo
A2517428Certificate of AnalysisJan 09, 2025 M698516
A2517429Certificate of AnalysisJan 09, 2025 M698516
A2517430Certificate of AnalysisJan 09, 2025 M698516
A2517431Certificate of AnalysisJan 09, 2025 M698516
A2517432Certificate of AnalysisJan 09, 2025 M698516
A2517439Certificate of AnalysisJan 09, 2025 M698516
A2517446Certificate of AnalysisJan 09, 2025 M698516
A2517447Certificate of AnalysisJan 09, 2025 M698516
Propiedades químicas y físicas
Punto de fusión (°C)148.5-154.5℃
Peso molecular309.940 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass309.866 Da
Monoisotopic Mass307.868 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count13
Formal Charge0
Complexity198.000
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
Calculadoras de soluciones
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