3-Nitrophthalic anhydride 3-硝基邻苯二甲酸酐

CAS 641-70-3 MFCD00005921

化学结构图

641-70-3
SMILES: O=C1OC(=O)c2c1cccc2[N+](=O)[O-]

化学属性

Mol. FormulaC8H3NO5
Mol. Weight193.11
Density1.422
Melting Point163-165°C
TSCAYes
SolubilityMAY DECOMPOSE
Appearance 白色针状结晶。熔点164℃。溶于丙酮、热乙醇和热乙酸，微溶于苯，不溶于水。
Boiling Point411.8°C at 760 mmHg

别名和识别编码

Chemical Name3-Nitrophthalic anhydride
CAS Number641-70-3
Alfabeta NameNITROPHTHALICANHYDRIDE 3-
MDL NumberMFCD00005921
Synonym 3-Nitrophthalic anhydride {LY} 3-Nitrophthalic anhydride {} {LY} 3-Nitrophthalic anhydride {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Nitrophthalic anhydride {} {} {} {} {} {} {} {} {} {}
EC Number211-373-6
Beilstein Registry Number179963
PubChem Substance ID87573606
Chemical Name Translation3-硝基邻苯二甲酸酐
Reaxys-RN179963
InChIKeyROFZMKDROVBLNY-UHFFFAOYSA-N
LabNetwork Molecule IDLN00173948
InChIInChI=1S/C8H3NO5/c10-7-4-2-1-3-5(9(12)13)6(4)8(11)14-7/h1-3H
Canonical SMILESO=C1OC(C2=C1C=CC=C2[N+]([O-])=O)=O
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分类

  • {SNA} Anhydride Monomers, Materials Science, Monomers, Polymer Science
  • {SA} Building Blocks, Carbonyl Compounds, Carboxylic Acid Anhydrides, Chemical Synthesis, Organic Building Blocks
  • {SNA} Anhydride Monomers, Monomers, Polymer Science, 材料科学
  • Amines
  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; carbo-anhydride; 1fragment
  • {SNA} Building Blocks, Carbonyl Compounds, Carboxylic Acid Anhydrides, Chemical Synthesis, Organic Building Blocks
  • Intermediates
  • Aromatics

产品应用

  • An intermediate for the synthesis of a benzimidazole PARP inhibitor I (succinate salt) (ABT-472).

相关文献及参考

  • Has been used as an N-blocking group for amino acids in solid-phase peptide synthesis, providing an acidic 'handle' allowing separation by ion-exchange chromatography: Angew. Chem. Int. Ed., 8, 764 (1969). See Appendix 6.
  • Short: EINECS
  • Short: III/35E
  • Denny, W., et al.: J. Med. Chem., 33, 814 (1990),

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Storage condition 2-8°C {LY} 2-8°C Moisture Sensitive Store at RT. {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Codes Xi

其他信息

  • 图谱信息:3-硝基邻苯二甲酸酐(641-70-3)核磁图( 1 HNMR) 3-硝基邻苯二甲酸酐(641-70-3)Raman光谱 3-硝基邻苯二甲酸酐(641-70-3)核磁图( 13 CNMR)
  • Acros Organics:3-硝基邻苯二甲酸酐 3-Nitrophthalic anhydride, 97%(641-70-3)
  • 3-硝基邻苯二甲酸酐价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 N0245 3-硝基邻苯二甲酸酐 3-Nitrophthalic Anhydride 25G 1100元 2014/06/02 N0245 3-硝基邻苯二甲酸酐 3-Nitrophthalic Anhydride 250G 6710元 2010/06/21 168990250 3-硝基邻苯二甲酸酐 3-Nitrophthalic anhydride 97% 25 GR 1496元
  • 方法一:由3-硝基邻苯二甲酸与乙酐共热而得。
  • MOL 文件:641-70-3.mol
  • Sigma Aldrich:641-70-3(sigmaaldrich)
  • Alfa Aesar:3-硝基邻苯二甲酸酐,97% 3-Nitrophthalic anhydride, 97%(641-70-3)
  • 上游原料:3-硝基邻苯二甲酸
  • 用途一:用于有机合成、颜料中间体
  • F:10-21
  • 用途二:用于有机合成及醇类的测定。
  • MSDS 信息:3-Nitrophthalic anhydride(641-70-3).msds
  • 敏感性:Moisture Sensitive
  • TCI Shanghai:3-硝基邻苯二甲酸酐 3-Nitrophthalic Anhydride,>;97.0%(T)(641-70-3)
  • 海关编码:29173980

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Nitro Compounds 硝基化合物
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acid Anhydrides 羧酸酐
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acid Anhydrides 羧酸酐
  1. Materials Science 材料科学
  2. Products for Polymer Science Research
  3. Monomers - Polymer Science
  4. Anhydride Monomers - Monomers
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carbonates
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Monomers
  4. Amine Monomers
  5. Tertiary Amines
  1. Functional Group 官能团索引
  2. carboxylic acid anhydride

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