2-(1H-Indol-1-yl)ethanol

Base Information

• Chemical Name: 2-(1H-Indol-1-yl)ethanol
• CAS No.: 121459-15-2
• Molecular Formula: C10H11NO
• Molecular Weight: 161.203
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID60547961
• Nikkaji Number: J1.728.503C
• Wikidata: Q82426515
• Mol file: 121459-15-2.mol

Synonyms:2-(1H-Indol-1-yl)ethanol;121459-15-2;1H-Indole-1-ethanol;2-indol-1-ylethanol;2-(1H-Indol-1-yl)ethan-1-ol;1-(2-hydroxyethyl)indole;indole-1-ethanol;2-(Indol-1-yl)ethanol;2-(indol-1-yl)-ethanol;2-(Indol-1-yl) ethanol;1-(2-hydroxy-ethyl)indole;SCHEMBL734246;DTXSID60547961;MWUVMGYIPOWLAH-UHFFFAOYSA-N;MFCD12964923;AKOS013123026;AS-49993;CS-0369855;O10447

Chemical Property of 2-(1H-Indol-1-yl)ethanol

Chemical Property:

• Melting Point: 42-43 °C
• Boiling Point: 141-142 °C(Press: 2.5 Torr)
• PKA: 14.87±0.10(Predicted)
• PSA: 25.16000
• Density: 1.11±0.1 g/cm3(Predicted)
• LogP: 1.63360
• Storage Temp.: 2-8°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 161.084063974
• Heavy Atom Count: 12
• Complexity: 149

Purity/Quality:

98%min ^*data from raw suppliers

2-(1H-Indol-1-yl)ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CN2CCO

Technology Process of 2-(1H-Indol-1-yl)ethanol

There total 20 articles about 2-(1H-Indol-1-yl)ethanol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%

indole (120-72-9) + 2-bromoethanol (540-51-2) → 2-(1H-indol-1-yl)ethanol (121459-15-2)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; at 20 ℃;

DOI:10.1039/c3ob40855h

Reference yield: 88.0%

1-<2-(Tetrahydropyran-2-yloxy)ethyl>-1H-indole (165532-66-1) → 2-(1H-indol-1-yl)ethanol (121459-15-2)

Guidance literature:

With toluene-4-sulfonic acid; In methanol; water; for 14h; Ambient temperature;

DOI:10.1021/jo00102a037

Reference yield: 82.0%

1-indolylacetic acid (24297-59-4) → 2-(1H-indol-1-yl)ethanol (121459-15-2)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 5h; Reflux;

DOI:10.3390/ph13120469

upstream raw materials:

oxirane

indole

1-<2-(Tetrahydropyran-2-yloxy)ethyl>-1H-indole

2-bromoethanol

Downstream raw materials:

4-(2-(1H-indol-1-yl)ethoxy)benzaldehyde

5-{4-[2-(1-indolyl)ethoxy]phenylmethyl}thiazolidine-2,4-dione

5-{4-[2-(indol-1-yl)ethoxy]benzyl}-3-triphenylmethylthiazolidine-2,4-dione

2-(1H-1-indolyl)ethyl 2-benzoylacetate

Refernces

• 1、 Nguyen, Tuan Minh,Duong, Hung A.,Richard, Jean-Alexandre,Johannes, Charles William,Pincheng, Fu,Kwong Jia Ye, Danson,Shuying, Eileen Lau. "Cascade fluorofunctionalisation of 2,3-unsubstituted indoles by means of electrophilic fluorination". . p. 10602 - 10604. Retrieved 2013.
• 2、 Chen, Zhuo,Lai, Mengzhen,Li, Honglin,Li, Shengqing,Su, Zhicheng,Tong, Linjiang,Wang, Jie,Wumaier, Gulinuer,Xie, Hua,Yang, Tingyuan,Zhao, Zhenjiang. "Design, synthesis and biological evaluation of potent EGFR kinase inhibitors against 19D/T790M/C797S mutation". . . Retrieved 2020.
• 3、 Chen, Hongbo,Deng, Qiang,Dong, Xuxu,Ren, Dazhuo,Tian, Wei,Wang, Dapeng,Xiao, Xuedong. "A Double Cation–π-Driven Strategy Enabling Two-Dimensional Supramolecular Polymers as Efficient Catalyst Carriers". . p. 9534 - 9541. Retrieved 2020.
• 4、 Niu, Xiaokang,Yang, Lei. "Manganese(III) Acetate Catalyzed Aerobic Dehydrogenation of Tertiary Indolines, Tetrahydroquinolines and an N-Unsubstituted Indoline". supporting information. p. 4209 - 4215. Retrieved 2021/08/06.
• 5、 -. "Preparation method for constructing two-dimensional organic layer based on cationic-pi interactions". Paragraph 0034; 0036; 0047; 0049; 0060; 0062. . Retrieved 2020/02/29.