3,5,5-Trimethylhexan-1-Ol 3,5,5-三甲基己醇
CAS 3452-97-9 MFCD00036138
化学结构图
SMILES: CC(CCO)CC(C)(C)C
化学属性
| Mol. Formula | C9H20O |
|---|---|
| Mol. Weight | 144.25 |
| Density | 0.824 |
| Refractive index | 1.4320 to 1.4340 |
| Boiling Point | 194°C at 760 mmHg |
| Flash Point | 81.11°C |
| Solubility | 不溶于水。 |
| Melting Point | 6.15 °C |
别名和识别编码
| Chemical Name | 3,5,5-Trimethylhexan-1-Ol |
|---|---|
| Synonym | 3,5,5-Trimethylhexan-1-ol {LY} 3,5,5-Trimethylhexan-1-ol {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexan-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} |
| CAS Number | 3452-97-9 |
| EC Number | 222-376-7 |
| Beilstein Registry Number | 1719424 |
| MDL Number | MFCD00036138 |
| PubChem Substance ID | 18938 |
| Chemical Name Translation | 3,5,5-三甲基己醇 |
| Reaxys-RN | 1719424 |
| LabNetwork Molecule ID | LN00193158 |
| InChI | InChI=1S/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3 |
| Canonical SMILES | CC(CCO)CC(C)(C)C |
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分类
- {SNA} Alphabetical Listings, Flavors and Fragrances, Q-Z
- {Chemicalbook} 食品添加剂: 食用香料（增香剂）: 天然等同香料和人造香
- {uni_hamburg} no charge; alcohol; racemate; 1fragment
- {SNA} Alcohols, Building Blocks, C9 to C10, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
相关文献及参考
- Short: III/47 Title: Optical Constants: Refractive Indices of Pure Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/47 Year: 2008 Keyword: binary liquid mixtures; inorganic liquid; optical constant; organic liquid; organoarsenic liquid; organoboron liquid; organometallic liquid; organophosphorus liquid; organosilicon liquid; organovanadic liquid; pure liquids; refractive index ISBN: 978-3-540-75289-9 (Print) ISBN: 978-3-540-75291-2 (Online) Internet Resource: DOI:10.1007/978-3-540-75291-2 RefComment: VII, 298 p., Hardcover RefComment: Written for scientists and engineers in the fields of physics, chemistry, and physical chemistry Abstract: This Landolt-Börnstein volume III/47 is a supplement to the volumes III/38 A/B "Optical Constants" and provides refractive index data published in the years 1995-2006. Included in this volume are refractive indices of inorganic, organometallic, organononmetallic, and organic liquids as well as their binary liquid mixtures at different wavelengths, temperatures, and pressures. Not all published data could be included in the printed version, but the electronic version contains all available data and references.
- Short: IV/17 Title: Static Dielectric Constants of Pure Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/17 Year: 2008 Keyword: binary liquid mixtures; inorganic liquid; organic liquid; organoboron liquid; organometallic liquid; organophosphorus liquid; organosilicon liquid; pure liquids; static dielectric constant ISBN: 978-3-540-75505-0 (Print) ISBN: 978-3-540-75506-7 (Online) Internet Resource: DOI:10.1007/978-3-540-75506-7 RefComment: VII, 203 p., Hardcover RefComment: Written for scientists and engineers in the fields of physics, chemistry and physical chemistry Abstract: This Landolt-Börnstein volume IV/17 is a supplement
安全信息
GHS Symbol
- S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
- R22 Harmful if swallowed 吞咽有害
- R36 Irritating to eyes 刺激眼睛
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
- R51/53
- R52/53
- P201 Obtain special instructions before use. 使用前获取专门指示。
- P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。
- P203
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/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
- P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
- 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。
- P281 Use personal protective equipment as required. 使用所需的个人防护装备。
- P301+P312
- P301+P312+P330
- P301+P317
- P302+P317
- P302+P350
- P302+P352
- P302+P352+P332+P313+P362+P364
- P305+P351+P338
- P305+P351+P338+P337+P313
- P308+P313
- 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。
- P314 Get medical advice/attention if you feel unwell. 获取医疗咨询/就医，如果你觉得不舒服
- P318
- P319
- P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
- P330 Rinse mouth. 漱口
- 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
- P370+P378
- P403 Store in a well-ventilated place. 储存在通风良好的地方。
- P403+P235
- P405 Store locked up. 上锁保管。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- H227 Combustible liquid 可燃液体
- H315 Causes skin irritation 会刺激皮肤
- H319 Causes serious eye irritation 严重刺激眼睛
- H373 May causes damage to organs through prolonged or repeated exposure 长期或频繁接触可能会损伤器官
- H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
- H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
其他信息
- MSDS 信息:3,5,5-三甲基己醇(3452-97-9).msds
- 3,5,5-三甲基-1-己醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 T0596 3,5,5-三甲基-1-己醇 3,5,5-Trimethyl-1-hexanol 500ML 241元 2011/04/16 T0596 3,5,5-三甲基-1-己醇 3,5,5-Trimethyl-1-hexanol 25ML 161元
- TCI Shanghai:3,5,5-三甲基-1-己醇 3,5,5-Trimethyl-1-hexanol,>;90.0%(GC)(3452-97-9)
- 图谱信息:3,5,5-三甲基-1-己醇(3452-97-9)质谱(MS) 3,5,5-三甲基-1-己醇(3452-97-9)红外图谱(IR1) 3,5,5-三甲基-1-己醇(3452-97-9)核磁图( 1 HNMR) 3,5,5-三甲基-1-己醇(3452-97-9)核磁图( 13 CNMR) 3,5,5-三甲基-1-己醇(3452-97-9)Raman光谱
- 3,5,5-三甲基-1-己醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T0596 3,5,5-三甲基-1-己醇 3,5,5-Trimethyl-1-hexanol 500ML 293元 2014/06/02 T0596 3,5,5-三甲基-1-己醇 3,5,5-Trimethyl-1-hexanol 25ML 196元
- 外观性质:无色液体, 略有气味。
- FEMA:3324
- 参考质量标准:FAO/WHO，1998 含量(GT-10-4) ≥97.0% 酸值(OT-4) ≤2.0 折射率(n D 20 ) 1.435 相对密度(d 20 20 ) 0.835
- 下游产品:
- 使用限量:FEMA：焙烤制品、调味品，均30.0mg/kg。
- MOL 文件:3452-97-9.mol
- Sigma Aldrich:3452-97-9(sigmaaldrich)
- 毒性:GRAS(FEMA)。
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