4-tert-Butylbenzoylchloride 4-叔丁基苯甲酰氯
CAS 1710-98-1 MFCD00000695
化学结构图
SMILES: CC(C)(C)c1ccc(C(=O)Cl)cc1
化学属性
| Mol. Formula | (CH3)3CC6H4COCl |
|---|---|
| Mol. Weight | 196.67 |
| Refractive index | n20/D 1.536(lit.) |
| Boiling Point | 135 °C/20 mmHg(lit.) |
| Density | 1.007 g/mL at 25 °C(lit.) |
| Flash Point | 87°(188°F) |
| TSCA | Yes |
| 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 Name | 4-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 Number | MFCD00000695 |
| CAS Number | 1710-98-1 |
| PubChem Substance ID | 74372 |
| EC Number | 216-973-1 |
| Beilstein Registry Number | 775793 |
| Chemical Name Translation | 4-叔丁基苯甲酰氯 |
| InChIKey | WNLMYNASWOULQY-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00189812 |
| InChI | InChI=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
- H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
- 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
- R37 Irritating to respiratory system 刺激呼吸道
- R34 Causes burns 会导致灼伤
- 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；
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
