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

  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. Indoles 吲哚
  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. Indoles 吲哚
  5. C13 to C27 - Indoles

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