2H-1,4-Benzoxazin-3(4H)-One 2H-1,4-苯并噁嗪-3(4H)-酮

CAS 5466-88-6 MFCD00158536

化学结构图

5466-88-6
SMILES: O=C1COc2ccccc2N1

化学属性

Mol. FormulaC8H7NO2
Mol. Weight149.15
Melting Point173-175°C
TSCANo
Boiling Point337.7°C at 760 mmHg

别名和识别编码

Chemical Name2H-1,4-Benzoxazin-3(4H)-One
CAS Number5466-88-6
Alfabeta NameBENZOXAZINONE HH21434()----,
MDL NumberMFCD00158536
PubChem Substance ID72757
Synonym 2H-1,4-Benzoxazin-3(4H)-one {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxazin-3(4H)-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2H-1,4-Benzoxaz
Chemical Name Translation2H-1,4-苯并噁嗪-3(4H)-酮
Reaxys-RN131133
InChIKeyQRCGFTXRXYMJOS-UHFFFAOYSA-N
LabNetwork Molecule IDLN00010813
InChIInChI=1S/C8H7NO2/c10-8-5-11-7-4-2-1-3-6(7)9-8/h1-4H,5H2,(H,9,10)
Canonical SMILESO=C1COC2=CC=CC=C2N1
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
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分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Benzoxazines, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks

安全信息

Warnings IRRITANT
WGK Germany3
GHS Symbol
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。
  • 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+P350
  • 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。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • 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
Hazard Codes Xi
RTECSDM3270000
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
2
Rotatable Bonds
0
LogP
3.525000000000000e-001

其他信息

  • Sigma Aldrich:5466-88-6(sigmaaldrich)
  • MOL 文件:5466-88-6.mol
  • 2H-1,4-苯并恶嗪-3(4H)-酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 372851000 2H-1,4-苯并恶嗪-3(4H)-酮 2H-1,4-Benzoxazin-3(4H)-one 99% 100 GR 3311元 2010/06/21 372850250 2H-1,4-苯并恶嗪-3(4H)-酮 2H-1,4-Benzoxazin-3(4H)-one 99% 25 GR 1014元 2010/05/25 H27622 2H-1,4-苯并恶嗪-3(4H)-酮, 99% 2H-1,4-Benzoxazin-3(4H)-one, 99% 5g 293元
  • Acros Organics:2H-1,4-苯并恶嗪-3(4H)-酮 2H-1,4-Benzoxazin-3(4H)-one, 99%(5466-88-6)
  • Alfa Aesar:2H-1,4-苯并恶嗪-3(4H)-酮,99% 2H-1,4-Benzoxazin-3(4H)-one, 99%(5466-88-6)

系列性分类


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