4-Bromobenzyl alcohol 4-溴苄醇
CAS 873-75-6 MFCD00004650
化学结构图
SMILES: OCc1ccc(Br)cc1
化学属性
| Mol. Formula | C7H7BrO |
|---|---|
| Mol. Weight | 187.03 |
| Melting Point | 75-77°C |
| Density | 1.422 |
| TSCA | No |
| Appearance | 白色结晶体。 |
| Boiling Point | 267.8°C at 760 mmHg |
别名和识别编码
| Chemical Name | 4-Bromobenzyl alcohol |
|---|---|
| Beilstein Registry Number | 1931620 |
| PubChem Substance ID | 70119 |
| CAS Number | 873-75-6 |
| EC Number | 212-851-7 |
| MDL Number | MFCD00004650 |
| Reaxys-RN | 1931620 |
| Synonym | (4-Bromophenyl)methanol {LY} (4-Bromophenyl)methanol {} {LY} (4-Bromophenyl)methanol {} {} {LY} (4-Bromophenyl)methanol {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (4-Bromophenyl)methanol {} {} {} {} {} {} {} {} {} {} {} {} {} { |
| Chemical Name Translation | 4-溴苄醇 |
| InChIKey | VEDDBHYQWFOITD-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00009236 |
| InChI | InChI=1S/C7H7BrO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2 |
| Canonical SMILES | BrC1=CC=C(CO)C=C1 |
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分类
- {SNA} Alcohols, B, Bioactive Small Molecules, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compo
- Alcohols, B, Bioactive Small Molecules, Building Blocks, C7 to C8, Cell Biology, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
- {SNA} Alcohols, B, Bioactive Small Molecule Alphabetical Index, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, 生物活性小分子, 细胞生物学
- {SN
相关文献及参考
- Beil. 6 ,IV,2602
- Aldrich MSDS 1 , 234:D / Corp MSDS 1 (1), 505:B / FT-IR 1 (1), 1135:A / FT-IR 2 (2), 1934:A / FT-NMR 1 (2), 352:A / IR-Spectra (3), 681:E / IR-Spectra (2), 607:D / NMR-Reference 2 (1), 938:D / RegBook 1 (1), 1325:M / Structure Index 1 , 203:D:6 / Vapor Phase 3 , 1059:B
- Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contai
安全信息
GHS Symbol
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- 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。
- P264+P265
- P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
- P273 Avoid release to the environment. 避免释放到环境中。
- 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。
- P302+P352
- P304+P340
- P305+P351+P338
- 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。
- P319
- P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
- P332+P313
- P332+P317
- P337+P313
- P337+P317
- 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
- P362+P364
- P403+P233
- P405 Store locked up. 上锁保管。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- H315 Causes skin irritation 会刺激皮肤
- H319 Causes serious eye irritation 严重刺激眼睛
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
其他信息
- MOL 文件:873-75-6.mol
- 4-溴苄醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 L0590901 4-溴苯甲醇, 99% 10g 405元 2011/04/16 B1372 4-溴苄醇 4-Bromobenzyl Alcohol 25G 790元 2010/06/21 181770500 4-溴苄醇 4-Bromobenzyl alcohol 99% 50 GR 1814元
- 图谱信息:4-溴苄醇(873-75-6)质谱(MS) 4-溴苄醇(873-75-6)核磁图( 1 HNMR) 4-溴苄醇(873-75-6)Raman光谱 4-溴苄醇(873-75-6)红外图谱(IR2) 4-溴苄醇(873-75-6)红外图谱(IR1) 4-溴苄醇(873-75-6)核磁图( 13 CNMR)
- Alfa Aesar:4-溴苄醇,99% 4-Bromobenzyl alcohol, 99%(873-75-6)
- Hazard Note:Irritant
- 上游原料:甲醇 --> 硼氢化钠 --> 4-溴苯甲醛
- Acros Organics:4-溴苄醇 4-Bromobenzyl alcohol, 99%(873-75-6)
- TCI Shanghai:4-溴苄醇 4-Bromobenzyl Alcohol,>;98.0%(GC)(873-75-6)
- Sigma Aldrich:873-75-6(sigmaaldrich)
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