10,11-Dihydro-5H-Dibenzo[A,D][7]Annulen-5-One 10,11-二氢二苯并[a,d]环庚烯-5-酮

CAS 1210-35-1 MFCD00003587

化学结构图

1210-35-1
SMILES: O=C1C2=CC=CC=C2CCC2C=CC=CC=21

化学属性

Mol. FormulaC15H12O
Mol. Weight208.26
Density1.156 g/mL at 25 °C(lit.)
Boiling Point148 °C at 0.3 mmHg
Melting Point32-34 ℃
Refractive indexn20/D 1.6332(lit.)
Flash Point200°(392°F)
TSCAYes
Solubility不溶

别名和识别编码

Chemical Name10,11-Dihydro-5H-Dibenzo[A,D][7]Annulen-5-One
CAS Number1210-35-1
Synonym Dibenzocycloheptenone {LY} Dibenzocycloheptenone {} {LY} Dibenzocycloheptenone {} {} {LY} Dibenzocycloheptenone {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dibenzocycloheptenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00003587
Beilstein Registry Number1454355
EC Number214-912-3
PubChem Substance ID87568270
Reaxys-RN1454355
Chemical Name Translation10,11-二氢二苯并[a,d]环庚烯-5-酮
LabNetwork Molecule IDLN00857278
Canonical SMILESO=C1C2=CC=CC=C2CCC3=CC=CC=C13
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分类

  • {SNA} Analytical Standards, Chromatography, EP Standards, EP Standards C - D, Pharmaceutical Standards, Pharmacopeia Standards, 分析/色谱
  • Building Blocks, C15 to C38, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • {SNA} Analytical Standards, EP Standards, EP Standards C - D, Pharmacopeia & Metrological Institutes Standards, 分析/色谱
  • {SNA} Building Blocks, C15 to C38, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • {SNA} Analytical Standards, Analytical/Chromatography, Chromatography,

产品应用

  • Amitriptyline (A633350) impurity, a potential antidepressant compound.

相关文献及参考

  • Flash vacuum pyrolysis gives anthracene in quantitative yield: Rec. Trav. Chim., 101, 317 (1982). For a study, with discussion of the mechanism, of the FVP of substituted dibenzosuberones to the corresponding anthracenes, see: J. Org. Chem., 60, 8407 (1995).
  • Campbell, T. W., et al.: Helv. Chimica Acta,?36,?1489 (1953),
  • Stelt, C., et al.: J. Med. Pharmaceut. Chem., 4,?335 (1961),

安全信息

RTECSHP1149700
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Signal word
Hazard statements
  • H303 May be harmfully swallowed 吞食可能有害
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • 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；
GHS Symbol 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1800 uL/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - ptosis
   Behavioral - ataxia
   Behavioral - coma
REFERENCE :
   ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology,
   Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128)  V.1-
   1990-  Volume(issue)/page/year: 1,186,1992

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

其他信息

  • MSDS 信息:Dibenzocycloheptadienone(1210-35-1).msds
  • 海关编码:29143900
  • Sigma Aldrich:1210-35-1(sigmaaldrich)
  • 10,11-二氢二苯并[a,b]环庚烯-5-酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D1801 二苯并环庚酮 Dibenzosuberone 500G 1880元 2014/06/02 D1801 二苯并环庚酮 Dibenzosuberone 25G 228元 2010/06/21 114741000 10,11-二氢二苯并[a,b]环庚烯-5-酮 Dibenzosuberone 97% 100 GR 917元
  • 用途一:用作医药中间体
  • 用途二:医药中间体，用于药物阿米替林的合成。
  • 方法一:由邻β-苯乙基苯甲酸经环合而得。
  • MOL 文件:1210-35-1.mol
  • 上游原料:乙基苯甲酸
  • TCI Shanghai:10,11-二氢二苯并[a,b]环庚烯-5-酮 Dibenzosuberone,>;97.0%(GC)(1210-35-1)
  • Alfa Aesar:二苯并环庚烯酮,97% Dibenzosuberone, 97%(1210-35-1)
  • 图谱信息:10,11-二氢二苯并[a,b]环庚烯-5-酮(1210-35-1)红外图谱(IR1) 10,11-二氢二苯并[a,b]环庚烯-5-酮(1210-35-1)核磁图( 1 HNMR) 10,11-二氢二苯并[a,b]环庚烯-5-酮(1210-35-1)质谱(MS)
  • Acros Organics:二苯并软木酮 Dibenzosuberone, 97%(1210-35-1)
  • 下游产品:5-二苯并环庚烯酮

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  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. Others 其他杂环
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C15 to C38 - Ketones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aromatic Ketones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones 酮
  6. C13 to C14
  1. Materials Science 材料科学
  2. Photopolymerization Initiators

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