3-(Trifluoromethyl)benzaldehyde 3-(三氟甲基)苯甲醛

CAS 454-89-7 MFCD00003373

化学结构图

454-89-7
SMILES: O=Cc1cccc(C(F)(F)F)c1

化学属性

Mol. FormulaC8H5F3O
Mol. Weight174.12
Boiling Point83-86°C at 760 mmHg
TSCAT
Refractive index1.4630 to 1.4660
Density1.301
Flash Point68°C
Appearance 浅黄色液体
Melting PointN/A

别名和识别编码

Chemical Name3-(Trifluoromethyl)benzaldehyde
CAS Number454-89-7
Alfabeta NameTRIFLUOROMETHYLBENZALDEHYDE 3()-
MDL NumberMFCD00003373
Synonym 3-(Trifluoromethyl)benzaldehyde {LY} 3-(Trifluoromethyl)benzaldehyde {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Trifluoromethyl)benzaldehyde {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID67990
EC Number207-228-1
Beilstein Registry Number2327537
Reaxys-RN2327537
Chemical Name Translation3-(三氟甲基)苯甲醛
InChIKeyNMTUHPSKJJYGML-UHFFFAOYSA-N
LabNetwork Molecule IDLN00116420
InChIInChI=1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H
Canonical SMILESFC(F)(F)C1=CC(C([H])=O)=CC=C1
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分类

  • Aldehydes, Building Blocks, C8, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks
  • {SNA} Aldehydes, Building Blocks, C8, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; aldehyde; 1fragment

相关文献及参考

  • Short: III/35D2
  • Beilstein:7(3)1016

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Hazard statements
  • H400 Verytoxictoaquaticlife 对水生生物毒性非常大。
  • 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
  • H227 Combustible liquid 可燃液体
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes 9
Precautionary statements
  • 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。
  • 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。
  • 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+P350
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P337+P313
  • 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
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Safety Statements
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾;
  • 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 Wear suitable protective clothing 穿戴适当的防护服;
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • 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;
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置;
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Air Sensitive {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under
Packing GroupIII
UN Number 3082

其他信息

  • MSDS 信息:alpha,alpha,alpha-Trifluoro-3-tolualdehyde(454-89-7).msds
  • 图谱信息:3-三氟甲基苯甲醛(454-89-7)核磁图( 13 CNMR) 3-三氟甲基苯甲醛(454-89-7)红外图谱(IR1) 3-三氟甲基苯甲醛(454-89-7)核磁图( 1 HNMR) 3-三氟甲基苯甲醛(454-89-7)质谱(MS)
  • 3-三氟甲基苯甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010179 间三氟甲基苯甲醛 5g 300元 2011/04/16 T1399 3-(三氟甲基)苯甲醛 3-(Trifluoromethyl)benzaldehyde 25G 1470元 2011/04/16 T1399 3-(三氟甲基)苯甲醛 3-(Trifluoromethyl)benzaldehyde 5G 478元
  • Alfa Aesar:3-(三氟甲基)苯甲醛,97% 3-(Trifluoromethyl)benzaldehyde, 97%(454-89-7)
  • 敏感性:Air Sensitive
  • TSCA:T
  • Hazard Note:Irritant
  • F:10-23
  • TCI Shanghai:3-三氟甲基苯甲醛 3-(Trifluoromethyl)benzaldehyde,>;95.0%(GC)(454-89-7)
  • Acros Organics:3-三氟甲基苯甲醛 alpha,alpha,alpha-Trifluoro-m-tolualdehyde, 97%(454-89-7)
  • 下游产品:3-(3-三氟甲基苯基)丙酸
  • 检测方法:GC,NMR
  • Sigma Aldrich:454-89-7(sigmaaldrich)
  • MOL 文件:454-89-7.mol

系列性分类


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