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· · COA & SDS すべての製品に適用 · 在庫品は当日出荷 1-Nitronaphthalene - ≥99% , CAS No.86-57-7
Synonyms
1-Nitronaphthalene, purum, >=98.0% (GC) | NITRONAPHTHALENE, 1- | A24106 | DTXSID7020978 | Naphthalene, nitro- | 1-Nitronaphthalene, BCR(R) certified Reference Material | InChI=1/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7 | NCGC00256373-01 | STR0342
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Why this grade ≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature 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.
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Literature proof Cited in 10 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
概要 Usually used to study excited state dynamics of 1-nitropthalene in nonpolar, aprotic and protic solvents.
Specifications 同義語
1-Nitronaphthalene, purum, >=98.0% (GC) | NITRONAPHTHALENE, 1- | A24106 | DTXSID7020978 | Naphthalene, nitro- | 1-Nitronaphthalene, BCR(R) certified Reference Material | InChI=1/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7 | NCGC00256373-01 | STR0342
生化学的・生理学的メカニズム
1- nitronaphthalene can covalently bind to protein and form an adduct in rat airway epithelium in vivo
名前と識別子 カノニカル・スマイル
C1=CC=C2C(=C1)C=CC=C2[N+](=O)[O-]
IUPAC Name
1-nitronaphthalene
InChIKey
RJKGJBPXVHTNJL-UHFFFAOYSA-N
INCHI
1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
異性体SMILES
C1=CC=C2C(=C1)C=CC=C2[N+](=O)[O-]
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1867714&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 Benzenoids 分類 Naphthalenes Subclass Nitronaphthalenes Intermediate Tree Nodes Not available Direct Parent Nitronaphthalenes Alternative Parents Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homopolycyclic compounds Substituents 1-nitronaphthalene - Nitroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homopolycyclic compound 説明 This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups. External Descriptors mononitronaphthalene 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.
3 D構造 関連ターゲット（人間） 関連ターゲット（非人間） 作用メカニズム 証明書（CoA、COO、BSE/TSEと分析図） 化学的性質と物理的性質 溶解度 H2O: insoluble;alcohol: soluble;carbon disulfide: freely soluble;chloroform: soluble;diethyl ether: freely soluble 引火点（°F） 327.2 °F 引火点（°C） 164℃ 沸点（°C） 304°C 融点（°C） 59-61°C 分子量 173.170 g/mol XLogP3 3.200 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 173.048 Da Monoisotopic Mass 173.048 Da Topological Polar Surface Area 45.800 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 200.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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