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· · COA & SDS Disponível para todos os produtos · Envio no mesmo dia em itens em estoque 1,3,6-Hexanetricarbonitrile - ≥98%(HPLC) , CAS No.1772-25-4
Disponível para encomenda
Synonyms
UNII-SJY3YNQ3SI | HSDB 5855 | DTXSID4041234 | SCHEMBL1323168 | 1,3,6-TRICYANOHEXANE | CAS-1772-25-4 | 1,3,6-Hexanetricarbonitrile | SJY3YNQ3SI | 4-Cyanosuberonitrile | hexane-1,3,6-tricarbonitrile | EINECS 217-199-7 | CHEMBL3183751 | HTCN
Storage
Room temperature,Argon charged,Desiccated
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Why this grade ≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged,Desiccated 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
UNII-SJY3YNQ3SI | HSDB 5855 | DTXSID4041234 | SCHEMBL1323168 | 1,3,6-TRICYANOHEXANE | CAS-1772-25-4 | 1,3,6-Hexanetricarbonitrile | SJY3YNQ3SI | 4-Cyanosuberonitrile | hexane-1,3,6-tricarbonitrile | EINECS 217-199-7 | CHEMBL3183751 | HTCN
Especificações e pureza
≥98%(HPLC)
Condições de armazenamento de armazenamento
Room temperature,Argon charged,Desiccated
Nomes e identificadores Pubchem Sid 504752694 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504752694 Sorrisos canónicos C(CC#N)CC(CCC#N)C#N IUPAC Name hexane-1,3,6-tricarbonitrile InChIKey LNLFLMCWDHZINJ-UHFFFAOYSA-N INCHI 1S/C9H11N3/c10-6-2-1-4-9(8-12)5-3-7-11/h9H,1-5H2 SMILES isoméricas C(CC#N)CC(CCC#N)C#N Peso molecular 161.21 Reaxy-Rn 1859243 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1859243&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 Kingdom Organic compounds Superclass Organic nitrogen compounds Classe Organonitrogen compounds Subclass Organic cyanides Intermediate Tree Nodes Not available Direct Parent Nitriles Alternative Parents Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound Descrição This 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 Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Estrutura 3D Certificados（CoA,COO,BSE/TSE e Mapa de Análise) Propriedades químicas e físicas Sensibilidade Air Sensitive Índice de refração 1.47 Ponto de inflamação (°C) 85°C(lit.) Ponto de ebulição (°C) 200°C/0.2mmHg(lit.) Peso molecular 161.200 g/mol XLogP3 0.400 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 5 Exact Mass 161.095 Da Monoisotopic Mass 161.095 Da Topological Polar Surface Area 71.400 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 253.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
Citations of This Product Referências 1. Shu Yang, Haonan Huang, Hailin Shen, Mengyuan Zhou, Liang Yuan, Yunyun Gao, Jinlei Zhang, Yike Wei, Changchun Ye, Weishan Li, Zhenghui Pan. (2025) Multi-functional nitrile-based electrolyte additives enable stable lithium metal batteries with high-voltage nickel-rich cathodes. Chemical Science, 16 (10): (4501-4511). [PMID:39926713 ] [10.1039/D4SC08045A ]
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Perguntas frequentes What are the CAS number, molecular formula and molecular weight? The CAS Number is 1772-25-4, the molecular formula is C9H11N3, and the molecular weight is 161.21 g/mol. InChIKey LNLFLMCWDHZINJ-UHFFFAOYSA-N.
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