4-Nitro-2-Picoline N-Oxide 4-硝基-2-甲基吡啶-N-氧化物

CAS 5470-66-6 MFCD00014625

化学结构图

5470-66-6
SMILES: Cc1cc([N+](=O)[O-])cc[n+]1[O-]

化学属性

Mol. FormulaC6H6N2O3
Mol. Weight154.13
Melting Point155-159
Density1.36
TSCANo
Appearance 淡黄色粉末状晶体。 powder

别名和识别编码

Chemical Name4-Nitro-2-Picoline N-Oxide
CAS Number5470-66-6
Alfabeta NameNITROPICOLINEOXIDE N42-----
MDL NumberMFCD00014625
Synonym 2-Methyl-4-nitropyridine N-oxide 4-NITRO-2-PICOLINE N-OXIDE (2-METHYL-4-NITROPYRIDINE-N-OXIDE)
EC Number000-000-0
Beilstein Registry Number135501
PubChem Substance ID95291
Reaxys-RN135501
Chemical Name Translation4-硝基-2-甲基吡啶-N-氧化物
InChIKeyFTTIAVRPJGCXAC-UHFFFAOYSA-N
Wiswesser Line NotationT6NJ AO B1 DNW
LabNetwork Molecule IDLN00008810
InChIInChI=1S/C6H6N2O3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3
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分类

  • Nitric Oxide Reagents
  • Aromatics
  • Heterocycles
  • {SNA} Building Blocks, C6, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines

产品应用

  • A nitroheterocyclic compound and its potential suitability as radiosensitizer for cancer radiotherapy.

相关文献及参考

  • Walton, M., et al.: Biochem. Pharmacol., 36, 887 (1987),
  • Beilstein:20(5)5,503

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R40 Limited evidence of a carcinogenic effect 有限证据表明其致癌作用
  • R68 Possible risk of irreversible effects 可能有不可挽回的作用的危险
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+P350
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P337+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
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H351 Suspected of causing cancer 怀疑致癌
  • H319 Causes serious eye irritation 严重刺激眼睛
RTECSUT5710000
Personal Protective Equipment Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Hazard Codes Xn Xn,Xi
Packing GroupIII
Hazard Class6.1
Storage condition 2-8°C
UN Number 2811 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1800 mg/kg/15W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   GANNA2 Gann.  Japanese Journal of Cancer Research.  (Tokyo, Japan)  V.1-75,
   1907-84.  For publisher information, see JJCREP.  Volume(issue)/page/year:
   70,799,1979

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 500 umol/L
REFERENCE :
   GANNA2 Gann.  Japanese Journal of Cancer Research.  (Tokyo, Japan)  V.1-75,
   1907-84.  For publisher information, see JJCREP.  Volume(issue)/page/year:
   70,799,1979

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - mouse Fibroblast
DOSE/DURATION           : 50 umol/L
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   35,521,1975

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 250 nmol/plate
REFERENCE :
   GANNA2 Gann.  Japanese Journal of Cancer Research.  (Tokyo, Japan)  V.1-75,
   1907-84.  For publisher information, see JJCREP.  Volume(issue)/page/year:
   70,799,1979

其他信息

  • color:yellow to light orange
  • 用途一:医药中间体。
  • MSDS 信息:2-Methyl-4-nitropyridine 1-oxide(5470-66-6).msds
  • Sigma Aldrich:5470-66-6(sigmaaldrich)
  • Alfa Aesar:4-硝基-2-甲基吡啶N-氧化物,98% 4-Nitro-2-picoline N-oxide, 98%(5470-66-6)
  • 2-甲基-4-硝基吡啶-N-氧化物价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M2114 2-甲基-4-硝基吡啶N-氧化物 2-Methyl-4-nitropyridine N-Oxide 25G 3180元 2014/06/02 M2114 2-甲基-4-硝基吡啶N-氧化物 2-Methyl-4-nitropyridine N-Oxide 5G 889元 2010/05/25 L06614 4-硝基-2-甲基吡啶 N-氧化物, 98% 4-Nitro-2-picoline N-oxide, 98% 5g 918元
  • MOL 文件:5470-66-6.mol
  • 检测方法:HPLC,NMR
  • 下游产品:4-羟基-2-甲基吡啶 --> 4-羟基吡啶-2-羧酸 --> 2-甲基-4-氨基吡啶 --> 4-氨基吡啶-2-甲酸 --> 4-溴吡啶-2-羧酸 --> 4-溴-2-甲基吡啶 --> 4-乙酰氨基吡啶-2-甲酸 --> 2-甲基-4-乙酰氨基吡啶 --> 2-甲基-4-硝基吡啶

系列性分类

  1. C6 - Pyridines
  1. C6 to C7 - Pyridines
  1. Functional Group 官能团索引
  2. N-oxide

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