1-Allylindoline-2,3-Dione 1-烯丙基-1H-吲哚-2,3-二酮

CAS 830-74-0 MFCD00224218

化学结构图

830-74-0
SMILES: C=CCN1C(=O)C(=O)c2ccccc21

化学属性

Mol. FormulaC11H9NO2
Mol. Weight187.19466
Melting Point87-90 °C
Boiling Point145 °C at 1 mmHg

别名和识别编码

Chemical Name1-Allylindoline-2,3-Dione
CAS Number830-74-0
Alfabeta NameALLYLINDOLEDIONE H1123-----,
MDL NumberMFCD00224218
Synonym 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Prop-2-en-1-yl)-2,3-dihydro-1h-indole-2,3-dione {} {} {} {} {} {} {} {}
Chemical Name Translation1-烯丙基-1H-吲哚-2,3-二酮
LabNetwork Molecule IDLN00146373
Reaxys-RN1528099
PubChem Substance ID354333758
InChIInChI=1S/C11H9NO2/c1-2-7-12-9-6-4-3-5-8(9)10(13)11(12)14/h2-6H,1,7H2
Canonical SMILESO=C1N(CC=C)C2=C(C=CC=C2)C1=O
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分类

  • {KO} Ketones
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Indolines

相关文献及参考

安全信息

Warnings IRRITANT
Safety Statements
  • 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；
  • 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；
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 statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
GHS Symbol
Signal word
Precautionary statements
  • 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
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

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 Acceptors
2
Rotatable Bonds
2
H-bond Donors
0
LogP
1

其他信息

  • MOL 文件:830-74-0.mol

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. Indolines 吲哚啉

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