Bromoacetonitrile - ≥97% , CAS No.590-17-0

CAS: 590-17-0 Cat. No.: B104455 Peso molecular: 119.95 Beilstein Registry Number: 956569 Número EC: 209-672-1
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
J-519939 | Cyanomethyl bromide | InChI=1/C2H2BrN/c3-1-2-4/h1H | 07K08J16VK | 2-Bromoacetonitrile; Bromoacetonitrile; Bromomethyl cyanide | BROMOACETONITRILE | bromo-acetonitrile | AS-12053 | AMY21970 | B1058 | Bromoacetonitrile, 97% | 4-02-00-00531 (Beils
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
B104455-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
9,90US$
25g
B104455-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
10,90US$
100g
B104455-100g
10

30,90US$

46,90US$
Guardar 16,00 US$ (34.12%)
500g
B104455-500g
4

115,90US$

173,90US$
Guardar 58,00 US$ (33.35%)
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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,Protected from light,Argon charged Ships Wet ice 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 9 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Bromoacetonitrile was used in the synthesis of 1-cyanomethyl-1,1-dimethylhydrazinium bromide.

Specifications

Sinónimos
J-519939 | Cyanomethyl bromide | InChI=1/C2H2BrN/c3-1-2-4/h1H | 07K08J16VK | 2-Bromoacetonitrile; Bromoacetonitrile; Bromomethyl cyanide | BROMOACETONITRILE | bromo-acetonitrile | AS-12053 | AMY21970 | B1058 | Bromoacetonitrile, 97% | 4-02-00-00531 (Beils
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Protected from light, 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
Sonrisas canónicasC(C#N)Br
IUPAC Name2-bromoacetonitrile
InChIKeyREXUYBKPWIPONM-UHFFFAOYSA-N
INCHI1S/C2H2BrN/c3-1-2-4/h1H2
Isómeros SMILES C(C#N)Br
WGK Alemania 3
RTECS AL7970000
Número ONU 3276
Grupo de embalaje I
Peso molecular 119.95
Beilstein 956569
Reaxy-Rn 956569
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=956569&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
SuperclassOrganic nitrogen compounds
ClaseOrganonitrogen compounds
SubclassOrganic cyanides
Intermediate Tree Nodes Not available
Direct ParentNitriles
Alternative Parents Organopnictogen compounds  Organobromides  Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
TP53 Tchem Cellular tumor antigen p53 (48468 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.

12 results found

Lot NumberCertificate TypeFechaArticulo
H2201061Certificate of AnalysisFeb 04, 2026 B104455
H2014360Certificate of AnalysisDec 09, 2025 B104455
H2014359Certificate of AnalysisDec 09, 2025 B104455
J2522146Certificate of AnalysisNov 03, 2025 B104455
B2225498Certificate of AnalysisSep 10, 2025 B104455
B2225502Certificate of AnalysisSep 10, 2025 B104455
B2225544Certificate of AnalysisSep 10, 2025 B104455
B2225549Certificate of AnalysisSep 10, 2025 B104455
D2010014Certificate of AnalysisNov 06, 2023 B104455
J1923182Certificate of AnalysisMay 09, 2023 B104455
A1809020Certificate of AnalysisMay 09, 2023 B104455
H1821034Certificate of AnalysisApr 25, 2022 B104455

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Propiedades químicas y físicas
SolubilidadInsoluble in water.
SensibilidadLight sensitive.;Moisture sensitive
Índice de refracción1.4786-1.4806
Punto de inflamación (°F)230 °F
Punto de inflamación (°C)>110°C
Punto de ebullición (°C)150 °C
Peso molecular119.950 g/mol
XLogP30.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass118.937 Da
Monoisotopic Mass118.937 Da
Topological Polar Surface Area23.800 Ų
Heavy Atom Count4
Formal Charge0
Complexity41.200
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
Citations of This Product
Referencias
1. Liang Wenfei, Nie Chengming, Du Jun, Han Yaoyao, Zhao Guohui, Yang Fan, Liang Guijie, Wu Kaifeng.  (2023)  Near-infrared photon upconversion and solar synthesis using lead-free nanocrystals.  Nature Photonics,  17  (4): (346-353).  [PMID:] [10.1038/s41566-023-01156-6]
2. Chongrui Zhang, Qiang Zhao.  (2021)  Facile preparation of water-proof paper with tunable surface properties for water/oil separation.  APPLIED SURFACE SCIENCE,      [PMID:] [10.1016/j.apsusc.2021.150738]
3. Feilong Dong, Jiaqi Liu, Cong Li, Qiufeng Lin, Tuqiao Zhang, Kejia Zhang, Virender K. Sharma.  (2019)  Ferrate(VI) pre-treatment and subsequent chlorination of blue-green algae: Quantification of disinfection byproducts.  ENVIRONMENT INTERNATIONAL,      [PMID:31654918] [10.1016/j.envint.2019.105195]
4. Sihan Tang, Zhiyue Dong, Xiangwei Zhu, Qiang Zhao.  (2019)  A poly(ionic liquid) complex membrane for pervaporation dehydration of acidic water-isopropanol mixtures.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2019.01.017]
5. Chen Qi-jing, An Ze-sheng.  (2016)  Synthesis of star polymeric ionic liquids and use as the stabilizers for high internal phase emulsions.  CHINESE JOURNAL OF POLYMER SCIENCE,  35  (1): (54-65).  [PMID:] [10.1007/s10118-016-1858-5]
6. Yanqin Yang, Qifeng Zhang, Shenghai Li, Suobo Zhang.  (2014)  Preparation and characterization of porous polyelectrolyte complex membranes for nanofiltration.  RSC Advances,  (5): (3567-3573).  [PMID:] [10.1039/C4RA13699C]
7. Lijie Gao, Jiawei Liu, Rui Zhang, Xi Chen, Mo Wang, Yujia Dong, Mykhaylo S. Frasinyuk, Wen Zhang, David Watt, Wenxiang Meng, Jun Xue, Chunming Liu, Yu Cheng, Xifu Liu.  (2025)  A novel amino-pyrimidine inhibitor suppresses tumor growth via microtubule destabilization and Bmi-1 down-regulation.  BIOCHEMICAL PHARMACOLOGY,      [PMID:39880315] [10.1016/j.bcp.2025.116783]
8. Xiaoyan He, Runze Cao, Jing Li, Zhilan Wang, Yanling Liang, Penggai Ma, Shuo Ma, Xin Tian, Yuanyuan Lu, Zhiqiang Wang, Xiaoquan Lu.  (2025)  Self-polymerized hydrogel for efficient solar-driven desalination, antibacterial properties and water purification.  DESALINATION,      [PMID:] [10.1016/j.desal.2025.118689]
9. Saleem Raza, Ata Ur Rehman, Zhiyu Zhao, Hua Li, Cheng Chen, Wei Yu, Ying Liu, Yanchao Xu, Liguo Shen, Hongjun Lin.  (2026)  Triatomic-doped MXene based catalyst with sodium alginate encapsulation their molecular and DFT calculation study for efficient photocatalytic removal of disinfected by-product from drinking water.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2026.173462]
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