Benzyl bromide - Moligand™, ≥98%(GC), stabilized with Propylene Oxide , Activator of TRPA1, CAS No.100-39-0, Activator of TRPA1

CAS: 100-39-0 Cat. No.: B108549 Peso molecular: 171.03 Beilstein Registry Number: 385801 Número EC: 202-847-3
Disponible para pedir
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(GC) stabilized with Propylene Oxide
Synonyms
benzyl bromine | (bromo methyl)benzene | Tox21_200018 | .alpha.-Bromotoluene | NCGC00257572-01 | UN 1737 | 1-(bromomethyl)benzene | BCP31679 | benzylbromide | Benzyl-bromide | SCHEMBL1066 | 1-Bromotoluene | bromomethylbenzene | bromomethyl-benzene | alpha
Storage
Protected from light,Room temperature,Argon charged
Shipped In
FedEx DG Service
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
25g
B108549-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

11,90US$

13,90US$
Guardar 2,00 US$ (14.39%)
100g
B108549-100g
≥10
37,90US$
250g
B108549-250g
≥10

59,90US$

83,90US$
Guardar 24,00 US$ (28.61%)
500g
B108549-500g
3

85,90US$

106,90US$
Guardar 21,00 US$ (19.64%)
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Why this grade

Moligand™, ≥98%(GC), stabilized with Propylene Oxide Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Room temperature,Argon charged Ships FedEx DG Service 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.

📚

Literature proof

Cited in 59 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Product Description:
Benzyl bromide is an aromatic halide that is mainly used as a protecting agent for protecting hydroxy group of alcohols via O-benzylation reaction. 


Product Application:
Benzyl bromide is widely useful in organic synthesis as a benzyl protecting group for alcohols and carboxylic acids. It is used in the preparation of foaming and frothing agents, quaternary ammonium compounds, peniclins, photographic chemicals, synthetic resins, dyes and plasticizers and esters. It is also involved in the synthesis of (E)-(2-Iodovinyl)benzene by reacting it with diiodomethane.

Specifications

Sinónimos
benzyl bromine | (bromo methyl)benzene | Tox21_200018 | .alpha.-Bromotoluene | NCGC00257572-01 | UN 1737 | 1-(bromomethyl)benzene | BCP31679 | benzylbromide | Benzyl-bromide | SCHEMBL1066 | 1-Bromotoluene | bromomethylbenzene | bromomethyl-benzene | alpha
Especificaciones y pureza
Moligand™, ≥98%(GC), stabilized with Propylene Oxide
Condiciones de almacenamiento de almacenamiento
Protected from light, Room temperature, Argon charged
Enviado en
FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Tipo de acción
ACTIVATOR
Mecanismo de acción
Activator of TRPA1
Pureza
≥98%(GC)
Nombres e identificadores
Pubchem Sid504751365
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504751365
Sonrisas canónicasC1=CC=C(C=C1)CBr
IUPAC Namebromomethylbenzene
InChIKeyAGEZXYOZHKGVCM-UHFFFAOYSA-N
INCHI1S/C7H7Br/c8-6-7-4-2-1-3-5-7/h1-5H,6H2
Isómeros SMILES C1=CC=C(C=C1)CBr
WGK Alemania 2
RTECS XS7965000
Número ONU 1737
Grupo de embalaje II
Peso molecular 171.03
Beilstein 385801
Reaxy-Rn 385801
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=385801&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
ClaseBenzene and substituted derivatives
SubclassBenzyl halides
Intermediate Tree Nodes Not available
Direct ParentBenzyl bromides
Alternative Parents Organobromides  Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzyl bromide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzyl bromides. These are organic compounds containing a benzene skeleton substituted with a bromomethyl group.
External Descriptors benzyl bromides
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
TRPA1 Tclin Transient receptor potential cation channel subfamily A member 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
VDR Tclin Vitamin D receptor (26531 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CXCL8 Tchem Interleukin-8 (642 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
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.

29 results found

Lot NumberCertificate TypeFechaArticulo
I2404104Certificate of AnalysisJun 09, 2026 B108549
L2213404Certificate of AnalysisMay 20, 2026 B108549
L2213401Certificate of AnalysisMay 20, 2026 B108549
G2015023Certificate of AnalysisNov 06, 2025 B108549
F2527044Certificate of AnalysisJul 17, 2025 B108549
D2601036Certificate of AnalysisJun 17, 2025 B108549
G2508255Certificate of AnalysisJun 17, 2025 B108549
G2508256Certificate of AnalysisJun 17, 2025 B108549
G2508337Certificate of AnalysisJun 17, 2025 B108549
G2508338Certificate of AnalysisJun 17, 2025 B108549
I2226246Certificate of AnalysisJun 04, 2024 B108549
G2404592Certificate of AnalysisApr 24, 2024 B108549
H2408148Certificate of AnalysisApr 24, 2024 B108549
L2116289Certificate of AnalysisSep 20, 2023 B108549
L2116339Certificate of AnalysisSep 20, 2023 B108549
L2116299Certificate of AnalysisSep 20, 2023 B108549
L2116326Certificate of AnalysisSep 20, 2023 B108549
L2116334Certificate of AnalysisSep 20, 2023 B108549
J2429084Certificate of AnalysisSep 20, 2023 B108549
L2410226Certificate of AnalysisSep 20, 2023 B108549
I2124054Certificate of AnalysisJun 16, 2023 B108549
I2124056Certificate of AnalysisJun 16, 2023 B108549
D2114355Certificate of AnalysisJan 13, 2023 B108549
D2114356Certificate of AnalysisJan 13, 2023 B108549
D2114354Certificate of AnalysisJan 13, 2023 B108549
L2213408Certificate of AnalysisDec 03, 2022 B108549
L2213413Certificate of AnalysisDec 03, 2022 B108549
L2213414Certificate of AnalysisDec 03, 2022 B108549
I2124246Certificate of AnalysisAug 26, 2021 B108549

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Propiedades químicas y físicas
SolubilidadMiscible with benzene, carbon tetrachloride, ethanol and ether.
SensibilidadLight & Moisture sensitive.
Índice de refracción1.5750
Punto de inflamación (°F)186.8 °F
Punto de inflamación (°C)86 °C
Punto de ebullición (°C)198-199°C
Punto de fusión (°C)-4.0°C
Peso molecular171.030 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass169.973 Da
Monoisotopic Mass169.973 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count8
Formal Charge0
Complexity55.400
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
Preguntas frecuentes y artículos
Citations of This Product
Referencias
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