5-Nitrofuran-2-carboxylic acid 5-硝基-2-糠酸

CAS 645-12-5 MFCD00003240

化学结构图

645-12-5
SMILES: O=C(O)c1ccc([N+](=O)[O-])o1

化学属性

Mol. FormulaC5H3NO5
Mol. Weight157.08
Melting Point185-189 °C
TSCANo
Boiling Point281.7 °C at 760 mmHg

别名和识别编码

Chemical Name5-Nitrofuran-2-carboxylic acid
Synonym 5-Nitrofuran-2-carboxylic acid {LY} 5-Nitrofuran-2-carboxylic acid {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Nitrofuran-2-carboxylic acid {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00003240
PubChem Substance ID12577
Beilstein Registry Number18(3/4)3992
CAS Number645-12-5
EC Number211-432-6
Reaxys-RN139373
Chemical Name Translation5-硝基-2-糠酸
Wiswesser Line NotationT5OJ BVQ ENW
InChIKeyIODMEDPPCXSFLD-UHFFFAOYSA-N
LabNetwork Molecule IDLN00195264
InChIInChI=1S/C5H3NO5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)
Canonical SMILESO=C(C1=CC=C([N+]([O-])=O)O1)O
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分类

  • {SNA} Building Blocks, C4 to C7, Chemical Synthesis, Furans, Heterocyclic Building Blocks

相关文献及参考

  • Beil. 18 ,V,6,139
  • FT-IR 2 (3), 3451:D / FT-IR 1 (2), 586:C / IR-Spectra (3), 1203:G / IR-Spectra (2), 1048:G / NMR-Reference 2 (2), 461:B / RegBook 1 (2), 2325:D / Sax 6 , 2020 / Sigma FT-IR 1 (2), 784:C / Structure Index 1 , 365:B:5

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • P305+P351+P338
Hazard statements
  • H319 Causes serious eye irritation 严重刺激眼睛
RTECSLV2012000
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Signal word Warning
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
Risk Statements
  • R68 Possible risk of irreversible effects 可能有不可挽回的作用的危险
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Hazard Codes Xn 
TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 350 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 130,97,1984

TYPE OF TEST            : Phage inhibition capacity
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 1 gm/L
REFERENCE :
   VIRLAX Virology.  (Academic Press, Inc., 1 E. First St., Duluth, MN 55802)
   V.1-    1955-  Volume(issue)/page/year: 99,257,1979

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 6250 ng/well
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 133,161,1984

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 75 ug/plate
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 7,1339,1986

Storage condition 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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • Sigma Aldrich:645-12-5(sigmaaldrich)
  • 5-硝基-2-糠酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 N0557 5-硝基-2-呋喃甲酸 5-Nitro-2-furancarboxylic Acid 5G 513元 2010/05/25 A10597 5-硝基-2-糠酸, 98+% 5-Nitro-2-furoic acid, 98+% 5g 270元 2010/05/25 A10597 5-硝基-2-糠酸, 98+% 5-Nitro-2-furoic acid, 98+% 25g 1114元
  • 上游原料:氢氧化钠 --> 乙酸乙酯 --> 乙醚 --> 硫酸 --> 石油醚 --> 硝酸 --> 硫酸钠 --> 乙酐 --> 碳酸氢钠 --> 吡啶 --> 对甲苯磺酸 --> 糠醛 --> 重铬酸钠
  • MOL 文件:645-12-5.mol
  • MSDS 信息:5-Nitro-2-furoic acid(645-12-5).msds
  • Alfa Aesar:5-硝基-2-糠酸,98+% 5-Nitro-2-furoic acid, 98+%(645-12-5)
  • TCI Shanghai:5-硝基呋喃-2-甲酸 5-Nitro-2-furancarboxylic Acid,>;97.0%(T)(645-12-5)
  • Acros Organics:5-硝基-2-糠酸 5-Nitro-2-furoic acid, 98%(645-12-5)
  • 图谱信息:5-硝基-2-糠酸(645-12-5)质谱(MS) 5-硝基-2-糠酸(645-12-5)Raman光谱 5-硝基-2-糠酸(645-12-5)红外图谱(IR1) 5-硝基-2-糠酸(645-12-5)红外图谱(IR2)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Furans 呋喃
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Furans 呋喃
  5. C4 to C7 - Furans

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