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· · COA & SDS すべての製品に適用 · 在庫品は当日出荷 Arecoline hydrobromide - analytical standard , CAS No.300-08-3
グレード＆純度 Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Synonyms
Areciline Hydrochloride,(S) | Nicotinic acid,2,5,6-tetrahydro-1-methyl-, methyl ester, hydrobromide | s2614 | SR-01000075307-1 | NCGC00093563-04 | UNII-24S79B9CX7 | BCP02923 | BCP9000314 | Q27253878 | NCGC00093563-03 | NICOTINIC ACID, 1,2,5,6-TETRAHYDRO-1
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このグレードを選ぶ理由 analytical standard 分析用標準物質 ベースライン干渉を最小限に抑える必要がある、感度の高いクロマトグラフィーおよび分析ワークフロー向け。
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保管・配送 Room temperature Normal に出荷。正確な仕様については、ロット固有の COA をご確認ください。
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品質書類 SDS、COA、データシート、仕様書をダウンロードできます。ロット固有の COA はロット番号検索で入手可能です。
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文献的裏付け クロマトグラフィー、有機合成、クロスカップリング反応に関する 2 件の査読済み論文で引用されています。
仕様 同義語
Areciline Hydrochloride,(S) | Nicotinic acid,2,5,6-tetrahydro-1-methyl-, methyl ester, hydrobromide | s2614 | SR-01000075307-1 | NCGC00093563-04 | UNII-24S79B9CX7 | BCP02923 | BCP9000314 | Q27253878 | NCGC00093563-03 | NICOTINIC ACID, 1,2,5,6-TETRAHYDRO-1
名前と識別子 カノニカル・スマイル
CN1CCC=C(C1)C(=O)OC.Br
IUPAC Name
methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate;hydrobromide
InChIKey
AXOJRQLKMVSHHZ-UHFFFAOYSA-N
INCHI
1S/C8H13NO2.BrH/c1-9-5-3-4-7(6-9)8(10)11-2;/h4H,3,5-6H2,1-2H3;1H
異性体SMILES
CN1CCC=C(C1)C(=O)OC.Br
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3914826&ln=
ドキュメント ✅ 分析証明書（COA） ロット固有の品質データ。ロット番号を入力して、正確な COA を取得してください。
COA を検索 →
詳細データ Taxonomic Classification Kingdom Organic compounds Superclass Alkaloids and derivatives 分類 Not available Subclass Not available Intermediate Tree Nodes Not available Direct Parent Alkaloids and derivatives Alternative Parents Hydropyridines Methyl esters Enoate esters Trialkylamines Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Hydrobromides Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Alkaloid or derivatives - Hydropyridine - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrobromide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aliphatic heteromonocyclic compound 説明 This compound belongs to the class of organic compounds known as alkaloids and derivatives. These are naturally occurring chemical compounds that contain mostly basic nitrogen atoms. This group also includes some related compounds with neutral and even weakly acidic properties. Also some synthetic compounds of similar structure are attributed to alkaloids. In addition to carbon, hydrogen and nitrogen, alkaloids may also contain oxygen, sulfur and more rarely other elements such as chlorine, bromine, and phosphorus. 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.
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 融点（°C） 171-175°C 分子量 236.110 g/mol XLogP3 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 235.021 Da Monoisotopic Mass 235.021 Da Topological Polar Surface Area 29.500 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 187.000 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 2
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