Methyl 4-iodobenzoate 4-碘苯甲酸甲酯

CAS 619-44-3 MFCD00016353

化学结构图

619-44-3
SMILES: COC(=O)c1ccc(I)cc1

化学属性

Mol. FormulaC8H7IO2
Mol. Weight262.04
Melting Point113-117°C
Density1.753
TSCAYes
Stability对光敏感
Appearance 白色结晶。
Boiling Point276.1°C at 760 mmHg

别名和识别编码

Chemical NameMethyl 4-iodobenzoate
CAS Number619-44-3
Alfabeta NameMETHYLIODOBENZOATE 4-
MDL NumberMFCD00016353
Synonym Methyl 4-iodobenzoate {LY} Methyl 4-iodobenzoate {} {LY} Methyl 4-iodobenzoate {} {} {LY} Methyl 4-iodobenzoate {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} { {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4-iodobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {}
PubChem Substance ID69273
EC Number210-597-1
Beilstein Registry Number2208132
Reaxys-RN2208132
Chemical Name Translation4-碘苯甲酸甲酯
InChIKeyDYUWQWMXZHDZOR-UHFFFAOYSA-N
LabNetwork Molecule IDLN00009499
InChIInChI=1S/C8H7IO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
Canonical SMILESO=C(OC)C1=CC=C(I)C=C1
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • Building Blocks, C8 to C9, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Short: III/20c Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Zr ... Bi. Diagrams, Structure formulas, Indexes Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20c Year: 1989 Keyword: NQR ISBN: 3-540-18490-2 ISBN: 978-3-540-18490-4 Internet Resource: DOI:10.1007/b35374 RefComment: 562 figs., IX,802 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
  • Short: III/31b Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Zn ... Bi. Diagrams, Indexes Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/31b Year: 1993 Keyword: NQR ISBN: 3-540-55147-6 ISBN: 978-3-540-55147-8 Internet Resource: DOI:10.1007/b46097 RefComment: 147 figs., VIII, 347 pages. Hardcover Abstract: Volume III/31 continues the compilation of nuclear quadrupole resonance spectroscopy data of solid substances which started in with volume III/20 in 1987 covering the literature from the beginning of nuclear quadrupole resonance spectroscopy in 1951 to 1982 and containing the data for 8000 substances in the solid state, distributed among three subvolumes III/20 a, b, and c. Volume III/31 covers the literature published in the period from the end of 1982 through the end of 1989. Included are the data for substances studied for the first time, as well as data for substances already present in the previous volume III/20 if the data published there could be completed or improved by new studies. In total there are 2500 substances i

安全信息

Warnings IRRITANT
WGK Germany3
Hazard Codes 9
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Signal word Warning
GHS Symbol
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；
  • S37 Wear suitable gloves 戴适当手套；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/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；
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
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
  • R51/53
Precautionary statements
  • 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
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+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。
  • 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
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • 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
  • H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light Light Sensitive {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect fro
UN Number 3077
Packing GroupIII

其他信息

  • Sigma Aldrich:619-44-3(sigmaaldrich)
  • 4-碘苯甲酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0593 4-碘苯甲酸甲酯 Methyl 4-Iodobenzoate 25G 1200元 2014/06/02 I0593 4-碘苯甲酸甲酯 Methyl 4-Iodobenzoate 5G 390元 2010/06/21 414460050 4-碘苯甲酸甲酯 Methyl 4-iodobenzoate 98% 5 GR 416元
  • TCI Shanghai:4-碘苯甲酸甲酯 Methyl 4-Iodobenzoate,>;98.0%(GC)(619-44-3)
  • MSDS 信息:Methyl 4-iodobenzoate(619-44-3).msds
  • Acros Organics:4-碘苯甲酸甲酯 Methyl 4-iodobenzoate, 98%(619-44-3)
  • Alfa Aesar:4-碘苯甲酸甲酯,98% Methyl 4-iodobenzoate, 98%(619-44-3)
  • 检测方法:GC,NMR
  • MOL 文件:619-44-3.mol
  • 图谱信息:4-碘苯甲酸甲酯(619-44-3)核磁图( 13 CNMR) 4-碘苯甲酸甲酯(619-44-3)红外图谱(IR2) 4-碘苯甲酸甲酯(619-44-3)核磁图( 1 HNMR) 4-碘苯甲酸甲酯(619-44-3)质谱(MS) 4-碘苯甲酸甲酯(619-44-3)红外图谱(IR1)

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. Halogenated Hydrocarbons 卤代烃
  5. Aryl 芳基卤代烃
  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. Esters - Carbonyl Compounds
  6. C8 to C9 - Esters
  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. Esters
  6. C6 to C7

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