4-Oxo-4H-1-benzopyran-2-carboxylic Acid 4-苯并吡喃酮-2-羧酸

CAS 4940-39-0 MFCD00006838

化学结构图

4940-39-0
SMILES: O=C(O)c1cc(=O)c2ccccc2o1

化学属性

Mol. FormulaC10H6O4
Mol. Weight190.15
Density1.493
Melting Point260°C
TSCANo
Solubility微溶
Boiling Point337°C at 760 mmHg

别名和识别编码

Chemical Name4-Oxo-4H-1-benzopyran-2-carboxylic Acid
CAS Number4940-39-0
Alfabeta NameOXOCHROMENECARBOXYLICACID H442-----
MDL NumberMFCD00006838
Synonym Chromocarb {LY} Chromocarb chromone-2-carboxylic acid {} {LY} Chromocarb {} {} {LY} Chromocarb {} {} {} {LY} Chromocarb {} {} {} {} {LY} Chromocarb {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chromocarb {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number225-583-0
Beilstein Registry Number146442
PubChem Substance ID2741
Merck Number2237
Reaxys-RN146442
Chemical Name Translation4-苯并吡喃酮-2-羧酸
Wiswesser Line NotationT66 BO EVJ CVQ
LabNetwork Molecule IDLN00177642
InChIInChI=1S/C10H6O4/c11-7-5-9(10(12)13)14-8-4-2-1-3-6(7)8/h1-5H,(H,12,13)
Canonical SMILESO=C(C1=CC(C2=CC=CC=C2O1)=O)O
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分类

  • {SNA} Benzopyrans, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, O, 生物活性小分子, 细胞生物学
  • {SNA} Benzopyrans, Bioactive Small Molecules, Building Blocks, Cell Biology, Chemical Synthesis, Heterocyclic Building Blocks, O
  • {SNA} Benzopyrans, Bioactive Small Molecules, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, O, 细胞生物学
  • {SNA} Benzopyrans, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks
  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; large ring; fused rings; 6ring; 10ring; carboxylic acid; ketone; ether; 1fragment

相关文献及参考

  • Short: EINECS
  • Short: III/35E
  • Merck: 14,2237
  • Merck: 14,2237 Beilstein:18(5)8,312

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。
  • P264+P265
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
RTECSDJ2476000
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
Hazard Codes Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 585 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PHTXA6 Pharmacology and Toxicology.  English translation of FATOAO.  (New
   York, NY)  V.20-22, 1957-59.  Discontinued.  Volume(issue)/page/year:
   21,555,1958

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

  • Alfa Aesar:色酮-2-甲酸,97% Chromone-2-carboxylic acid, 97%(4940-39-0)
  • TCI Shanghai:4-氧代-4H-1-苯并吡喃-2-甲酸 4-Oxo-4H-1-benzopyran-2-carboxylic Acid,>;98.0%(LC)(T)(4940-39-0)
  • MSDS 信息:4-Oxo-4H-1-benzopyran-2-carboxylic acid(4940-39-0).msds
  • MOL 文件:4940-39-0.mol
  • Hazard Note:Irritant
  • Acros Organics:4-Oxo-4H-1-benzopyran-2-carboxylic acid, 97%(4940-39-0)
  • 4-苯并吡喃酮-2-羧酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 O0290 4-氧代-4H-1-苯并吡喃-2-甲酸 4-Oxo-4H-1-benzopyran-2-carboxylic Acid 5G 571元 2014/06/02 O0290 4-氧代-4H-1-苯并吡喃-2-甲酸 4-Oxo-4H-1-benzopyran-2-carboxylic Acid 25G 1980元 2010/06/21 123880050 4-苯并吡喃酮-2-羧酸 4-Oxo-4H-1-benzopyran-2-carboxylic acid 97% 5 GR 437元
  • 微溶于水,溶于胺和乙醇。
  • 图谱信息:4-苯并吡喃酮-2-羧酸(4940-39-0)核磁图( 13 CNMR) 4-苯并吡喃酮-2-羧酸(4940-39-0)质谱(MS) 4-苯并吡喃酮-2-羧酸(4940-39-0)红外图谱(IR2) 4-苯并吡喃酮-2-羧酸(4940-39-0)核磁图( 1 HNMR) 4-苯并吡喃酮-2-羧酸(4940-39-0)红外图谱(IR1)

系列性分类


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