2-(2,5-dimethyl-1H-pyrrol-1-yl)aniline 2-(2,5-二甲基-1H-吡咯-1-基)苯胺

CAS 2405-01-8 MFCD01860278

化学结构图

2405-01-8
SMILES: Cc1ccc(C)n1-c1ccccc1N

化学属性

Mol. FormulaC12H14N2
Mol. Weight186.25
Melting Point79 - 81

别名和识别编码

Chemical Name2-(2,5-Dimethyl-1H-pyrrol-1-yl)phenylamine
CAS Number2405-01-8
Alfabeta NameDIMETHYLPYRROLYLPHENYLAMINE H22511()------,
MDL NumberMFCD01860278
Synonym 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(2,5-Dimethyl-1H-pyrrol-1-yl)aniline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(
Chemical Name Translation2-(2,5-二甲基-1H-吡咯-1-基)苯胺
PubChem Substance ID737560
LabNetwork Molecule IDLN00120811
InChIInChI=1S/C12H14N2/c1-9-7-8-10(2)14(9)12-6-4-3-5-11(12)13/h3-8H,13H2,1-2H3
Canonical SMILESNC1=CC=CC=C1N2C(C)=CC=C2C
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分类

  • {KO} Anilines
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Pyrroles

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
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
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • 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。
  • P301+P317
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P317
  • P337+P317
  • 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.....
Signal word Danger
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；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H332 Harmful if inhaled 吸入有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Storage condition

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
0
Rotatable Bonds
1
H-bond Donors
1
LogP
2

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. Pyrroles 吡咯

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