4-tert-Butylbenzoylchloride 4-叔丁基苯甲酰氯

CAS 1710-98-1 MFCD00000695

化学结构图

1710-98-1
SMILES: CC(C)(C)c1ccc(C(=O)Cl)cc1

化学属性

Mol. Formula(CH3)3CC6H4COCl
Mol. Weight196.67
Refractive indexn20/D 1.536(lit.)
Boiling Point135 °C/20 mmHg(lit.)
Density1.007 g/mL at 25 °C(lit.)
Flash Point87°(188°F)
TSCAYes
Appearance 对叔丁基苯甲酰氯(1710-98-1)为无色或微黄液体，遇水或醇分介，溶于苯，沸点135°C/2660Pa。

别名和识别编码

Chemical Name4-tert-Butylbenzoylchloride
Synonym 4-tert.-Butylbenzoesäurechlorid 4-(1,1-Dimethylethyl)benzoyl chloride 4-tert-Butylbenzoyl chloride 4-tert.-Butyl-benzoylchlorid P-T-BUTYLBENZOYL CHLORIDE Benzoylchloride,p-tert-butyl- 4-TERT-BUTYLBENZOYL CHLORIDE 4-tert-Butylbenzoylchloride; 4-(1,1-Dimethylethyl)-Benzoyl chloride 4-叔丁基苄氧氯 butylbenzoylchloride Benzoyl chloride, 4-(1,1-dimethylethyl)- 4-tert-Butyl-benzoyl chloride 4-tert-Butylbenzoylchlorid p-tert-Butylbenzoyl chloride 4-TERT-BTUYLBENZOYLCHLORIDE Benzoylchloride,4-(1,1-dimethylethyl)- 4-t-Butylbenzoyl chloride 对叔丁基苯甲酰氯 4-tert-Butylbenzoyl chloride, 98+% 4-(1,1-dimethylethyl)-benzoylchlorid 4-叔丁基苯甲酰氯 4-tert-Butylbenzoic acid chloride P-TERT-BUTYLBENZOYL CHLORIDE 4-tert-Butylbenzoesäurechlorid Benzoyl chloride, p-tert-butyl- 4-(1,1-Dimethylethyl)-Benzoyl chloride
MDL NumberMFCD00000695
CAS Number1710-98-1
PubChem Substance ID74372
EC Number216-973-1
Beilstein Registry Number775793
Chemical Name Translation4-叔丁基苯甲酰氯
InChIKeyWNLMYNASWOULQY-UHFFFAOYSA-N
LabNetwork Molecule IDLN00189812
InChIInChI=1S/C11H13ClO/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carbonyl chloride; 1fragment
  • {SNA} Acid Halides, Building Blocks, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Precautionary statements
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • 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。
  • P305+P351+P338
Signal word Danger
Packing GroupII
UN Number UN3265 UN 3265 8/PG 2
Risk Statements
  • R37 Irritating to respiratory system 刺激呼吸道
  • R34 Causes burns 会导致灼伤
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；
  • 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；
  • 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）；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Storage condition Moisture Sensitive
Hazard Codes C
Hazard Class8

其他信息

  • 图谱信息:对叔丁基苯甲酰氯(1710-98-1)Raman光谱 对叔丁基苯甲酰氯(1710-98-1)核磁图( 13 CNMR) 对叔丁基苯甲酰氯(1710-98-1)红外图谱(IR1) 对叔丁基苯甲酰氯(1710-98-1)质谱(MS) 对叔丁基苯甲酰氯(1710-98-1)核磁图( 1 HNMR)
  • 上游原料:乙醚 --> N,N-二甲基甲酰胺 --> 氧氯化硫 --> 对叔丁基苯甲酸
  • F:9-21
  • 用途一:用于医药中间体，有机合成。
  • Acros Organics:4-叔丁基苯甲酰氯 4-tert-Butylbenzoyl chloride, 98%(1710-98-1)
  • MOL 文件:1710-98-1.mol
  • Sigma Aldrich:1710-98-1(sigmaaldrich)
  • 海关编码:29163900
  • MSDS 信息:4-tert-Butylbenzoyl chloride(1710-98-1).msds
  • Alfa Aesar:4-叔丁基苯甲酰氯,98% 4-tert-Butylbenzoyl chloride, 98%(1710-98-1)
  • 敏感性:Moisture Sensitive
  • 对叔丁基苯甲酰氯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 169100050 对叔丁基苯甲酰氯 4-tert-Butylbenzoyl chloride 98% 5 GR 162元 2010/06/21 169101000 对叔丁基苯甲酰氯 4-tert-Butylbenzoyl chloride 98% 100 GR 1107元 2010/06/21 169100250 对叔丁基苯甲酰氯 4-tert-Butylbenzoyl chloride 98% 25 GR 459元

系列性分类

  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
  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. Acid Halides 酸性卤化物(酰氯等)
  1. Acyl halide
  2. acyl chloride

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