Ethanol, 2-[(2-methylphenyl)amino]-

Base Information

• Chemical Name: Ethanol, 2-[(2-methylphenyl)amino]-
• CAS No.: 136-80-1
• Molecular Formula: C9H13 N O
• Molecular Weight: 151.208
• Hs Code.: 2921499090
• European Community (EC) Number: 205-260-0
• NSC Number: 2152
• UNII: 5ZU21R1XXN
• DSSTox Substance ID: DTXSID5059664
• Nikkaji Number: J36.820B
• Wikidata: Q81988916
• Mol file: 136-80-1.mol

Synonyms:136-80-1;2-(o-Tolylamino)ethanol;N-(2-Hydroxyethyl)-2-methylaniline;o-Tolyl ethanolamine;Ethanol, 2-[(2-methylphenyl)amino]-;2-o-Tolylamino-ethanol;o-Toluidino ethanol;2-o-Tolylaminoethanol;2-(o-Toluidino)ethanol;N-(2-Hydroxyethyl)-o-toluidine;2-(2-methylanilino)ethanol;Ethanol, 2-o-toluidino-;2-o-Toluidinoethanol;Emery 5711;ETHANOL, 2-TOLUIDINO-;NSC 2152;Ethanol, 2-((2-methylphenyl)amino)-;N-beta-Hydroxyethyl-o-toluidine;N-beta-Hydroxyethyl-o-toluidino-;N-.beta.-Hydroxyethyl-o-toluidine;N-(o-Tolyl)ethanolamine;EINECS 205-260-0;BRN 1210606;5ZU21R1XXN;NSC-2152;MFCD00083105;4-12-00-01750 (Beilstein Handbook Reference);NSC2152;2-[(2-methylphenyl)amino]ethan-1-ol;2- o -Tolylamino-ethanol;UNII-5ZU21R1XXN;2-(2-Toluidino)ethanol #;SCHEMBL56497;WLN: Q2MR B1;DTXSID5059664;3,5-Dinitro-4-phenoxybenzoicacid;AMY20579;AKOS000258864;2-((2-METHYLPHENYL)AMINO)ETHANOL;AS-31207;LS-67066;SY012279;CS-0152948;ETHANOL,2-[(2-METHYLPHENYL)AMINO]-;FT-0629145;A886634

Chemical Property of Ethanol, 2-[(2-methylphenyl)amino]-

Chemical Property:

• Vapor Pressure: 0.00131mmHg at 25°C
• Refractive Index: 1.5675
• Boiling Point: 285.5°C at 760 mmHg
• PKA: 14.68±0.10(Predicted)
• Flash Point: 145.6°C
• PSA: 32.26000
• Density: 1.086g/cm³
• LogP: 1.47220
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 151.099714038
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

99% ^*data from raw suppliers

2-o-Tolylamino-ethanol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=CC=C1NCCO

Technology Process of Ethanol, 2-[(2-methylphenyl)amino]-

There total 12 articles about Ethanol, 2-[(2-methylphenyl)amino]- 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: 97.0%

2-methylphenyl bromide (95-46-5) + ethanolamine (141-43-5) → 2-(2-tolylamino)ethan-1-ol (136-80-1)

Guidance literature:

With copper(l) chloride; potassium hydroxide; at 90 ℃; for 8h; Neat (no solvent);

DOI:10.1016/j.tetlet.2011.12.130

Reference yield: 88.0%

Iodoethanol (624-76-0) + o-toluidine (95-53-4) → 2-(2-tolylamino)ethan-1-ol (136-80-1)

Guidance literature:

at 90 ℃; for 6h; Inert atmosphere;

DOI:10.1021/ol901189m

Reference yield: 83.1%

oxirane (75-21-8,99932-75-9) + o-toluidine (95-53-4) → 2-(2-tolylamino)ethan-1-ol (136-80-1)

Guidance literature:

With aluminum (III) chloride; In tetrahydrofuran; at 0 ℃; for 10h;

upstream raw materials:

oxirane

o-toluidine

N-(o-tolyl)-(2-chloroethyl) carbamate

2-chloro-ethanol

Downstream raw materials:

phenyl-(3-o-tolyl-thiazolidin-2-yliden)-amine

2-(methyl(o-tolyl)amino)ethan-1-ol

Refernces

• 1、 -. "A method for the preparation of indole compounds and use thereof (by machine translation)". Paragraph 0035-0039. . Retrieved 2018/04/01.
• 2、 Solé, Daniel,Mariani, Francesco,Bennasar, M.-Llu?sa,Fernández, Israel. "Palladium-catalyzed intramolecular carbene insertion into C(sp3)-H bonds". supporting information. p. 6467 - 6470. Retrieved 2016/06/01.