3-Ethoxybenzoic acid 3-乙氧基苯甲酸

CAS 621-51-2 MFCD00016517

化学结构图

621-51-2
SMILES: CCOc1cccc(C(=O)O)c1

化学属性

Mol. FormulaC9H10O3
Mol. Weight166.18
Melting Point136-140°C
TSCANo
Appearance 浅黄色液体。
Boiling Point254.38 °C at 760 mmHg

别名和识别编码

Chemical Name3-Ethoxybenzoic acid
CAS Number621-51-2
Alfabeta NameETHOXYBENZOICACID 3-
MDL NumberMFCD00016517
PubChem Substance ID12126
EC Number210-690-7
Beilstein Registry Number509159
Synonym 3-Ethoxybenzoic acid {LY} 3-Ethoxybenzoic acid {} {LY} 3-Ethoxybenzoic acid {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation3-乙氧基苯甲酸
InChIKeyDTFQMPQJMDEWKJ-UHFFFAOYSA-N
LabNetwork Molecule IDLN00131882
InChIInChI=1S/C9H10O3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3,(H,10,11)
Canonical SMILESO=C(O)C1=CC=CC(OCC)=C1
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分类

  • Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; ether; 1fragment
  • {SNA} Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • 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

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
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；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
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
Hazard Codes Xi
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • Alfa Aesar:3-乙氧基苯甲酸,98+% 3-Ethoxybenzoic acid, 98+%(621-51-2)
  • MOL 文件:621-51-2.mol
  • Sigma Aldrich:621-51-2(sigmaaldrich)

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. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C9 - Carboxylic Acids

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