423564

4-ブロモメチル-3-ニトロ安息香酸

97%

• 化学式: BrCH₂C₆H₃(NO₂)CO₂H
• CAS番号: 55715-03-2
• 分子量: 260.04
• Beilstein: 1970939
• MDL番号: MFCD00216575
• UNSPSCコード: 12352100
• PubChem Substance ID: 24866507
• NACRES: NA.22

特性

• 品質水準: 100
• アッセイ: 97%
• フォーム: solid
• mp: 127-130 °C (lit.)
• 溶解性: DMF: soluble(lit.); dichloromethane: soluble(lit.)
• 官能基: bromo; carboxylic acid; nitro
• SMILES記法: OC(=O)c1ccc(CBr)c(c1)[N+]([O-])=O
• InChI: 1S/C8H6BrNO4/c9-4-6-2-1-5(8(11)12)3-7(6)10(13)14/h1-3H,4H2,(H,11,12)
• InChI Key: QMAHVAFURJBOFV-UHFFFAOYSA-N

詳細

詳細

4-Bromomethyl-3-nitrobenzoic acid (BNBA) is a benzoic acid derivative. It has been synthesized by the nitration of 4-bromomethylbenzoic acid using fuming nitric acid. It participates in the synthesis of 3,4-dihydro-2(1H)-quinazolinones and 3,4-dihydro-1H-quinazolin-2-thiones.

アプリケーション

4-Bromomethyl-3-nitrobenzoic acid may be used in the following studies:

• As a reactant in the synthesis of 4-bromomethyl-3-nitrobenzoic acid succinimide ester (BNBA-SE).
• As a reactant in the synthesis of 4-(2-hydroxyethylmercaptylmethyl)-3-nitrobenzoic acid.
• As a reactant in the synthesis of decyl 4-(bromomethyl)-3-nitrobenzoate.
• As a reactant in the synthesis of 4-((2-(hydroxymethyl)phenylamino)methyl)-3-nitrobenzoic acid.
• As a thiol photo-deprotection reagent.
• As a UV-cleavable reagent to functionalize polyacrylamide acryl hydrate (PAAH).
• As a photocleavable linker to form localized photoinversion of surface charges inside the colloidal crystal.
• As a starting material in the synthesis of 2H-indazole based library using parallel solution-phase methods.
• As a reactant in the synthesis of (N-allyloxycarbonyl)-5-aminopent-1-yl 4-bromomethyl-3-nitrobenzoate.

安全性情報

• ピクトグラム: GHS05
• シグナルワード: Danger
• 危険有害性情報: H314
• 注意書き: P260 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363
• 危険有害性の分類: Skin Corr. 1B
• 保管分類コード: 8A - Combustible corrosive hazardous materials
• WGK: WGK 3
• 引火点(°F): Not applicable
• 引火点(℃): Not applicable
• 個人用保護具 (PPE): Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges