1-Phenylisatin 1-苯基靛红

CAS 723-89-7 MFCD00082681

化学结构图

723-89-7
SMILES: O=C1C(=O)N(c2ccccc2)c2ccccc21

化学属性

Mol. FormulaC14H9NO2
Mol. Weight223.22676
Melting Point138-140 °C
TSCANo
Boiling Point388.8±25.0 °C at 760 mmHg

别名和识别编码

Chemical Name1-Phenylisatin
CAS Number723-89-7
Alfabeta NamePHENYLINDOLEDIONE H1123-----,
MDL NumberMFCD00082681
EC Number000-000-0
Beilstein Registry Number0164531
Synonym 1-Phenylindoline-2,3-dione {LY} 1-Phenylindoline-2,3-dione {} {LY} 1-Phenylindoline-2,3-dione {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Phenylindoline-2,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {
PubChem Substance ID253660500
Chemical Name Translation1-苯基靛红
InChIKeyUWCPWBIMRYXUOU-UHFFFAOYSA-N
Reaxys-RN164531
Wiswesser Line NotationT56 BNVVJ BR
LabNetwork Molecule IDLN00148656
InChIInChI=1S/C14H9NO2/c16-13-11-8-4-5-9-12(11)15(14(13)17)10-6-2-1-3-7-10/h1-9H
Canonical SMILESO=C1N(C2=CC=CC=C2)C(C=CC=C3)=C3C1=O
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

  • {SNA} Building Blocks, C13 to C27, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • {KO} Ketones

安全信息

Warnings IRRITANT
RTECSNL7984000
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。
  • 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+P310
  • P301+P312+P330
  • P302+P350
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
  • 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
  • H301 Toxic if swallowed 吞食有毒
  • H302 Harmful if swallowed 吞食有害
  • H311 Toxic in contact with skin 皮肤接触中毒
  • H315 Causes skin irritation 会刺激皮肤
  • H331 Toxic if inhaled 吸入中毒
Signal word Danger Warning
Personal Protective Equipment Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Hazard Codes T Xn
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;
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后,立即用大量…(由生产厂家指定)冲洗;
  • S27 Take off immediately all contaminated clothing 立即脱掉全部污染的衣服;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Risk Statements
  • R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入,皮肤接触及吞食都有毒
  • R22 Harmful if swallowed 吞咽有害
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 425 mg/kg
TOXIC EFFECTS :
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   PCJOAU Pharmaceutical Chemistry Journal (English Translation).  Translation
   of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013)  No.1-
   1967-  Volume(issue)/page/year: 15,858,1981

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

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
1
H-bond Donors
0
LogP
2

其他信息

  • 1-苯基靛红,98%价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 L11388 1-苯基靛红, 98% 1-Phenylisatin, 98% 5g 1442元 2010/05/25 L11388 1-苯基靛红, 98% 1-Phenylisatin, 98% 1g 326元
  • MOL 文件:723-89-7.mol
  • Sigma Aldrich:723-89-7(sigmaaldrich)
  • Alfa Aesar:1-苯基靛红,98% 1-Phenylisatin, 98%(723-89-7)

系列性分类


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