3-(2-Aminoethyl)aniline

Base Information

• Chemical Name: 3-(2-Aminoethyl)aniline
• CAS No.: 76935-75-6
• Molecular Formula: C8H12N2
• Molecular Weight: 136.197
• Hs Code.: 2921590090
• European Community (EC) Number: 676-199-9
• DSSTox Substance ID: DTXSID20602828
• Nikkaji Number: J2.681.662I
• Wikidata: Q72436639
• Mol file: 76935-75-6.mol

Synonyms:3-(2-aminoethyl)aniline;76935-75-6;3-(2-Amino-ethyl)-aniline;3-(2-AMINO-ETHYL)-PHENYLAMINE;MFCD05663958;m-(2-aminoethyl) aniline;3-(2-aminoethyl)benzenamine;3-(2-Aminoethyl)-phenylamine;SCHEMBL2168809;3-AMINO-BENZENEETHANAMINE;DTXSID20602828;LJQFYBCLMVVNAQ-UHFFFAOYSA-N;AKOS006293473;AB22060;AC-6720;AS-35810;DA-17125;DB-056159;A9749;EN300-118066

Chemical Property of 3-(2-Aminoethyl)aniline

Chemical Property:

• Appearance/Colour: Solid
• Vapor Pressure: 0.004mmHg at 25°C
• Refractive Index: 1.595
• Boiling Point: 278.935 °C at 760 mmHg
• PKA: 9.99±0.10(Predicted)
• Flash Point: 144.432 °C
• PSA: 52.04000
• Density: 1.062 g/cm³
• LogP: 2.05150
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 136.100048391
• Heavy Atom Count: 10
• Complexity: 93.3

Purity/Quality:

97% ^*data from raw suppliers

3-(2-Amino-ethyl)-phenylamine 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)N)CCN

Technology Process of 3-(2-Aminoethyl)aniline

There total 14 articles about 3-(2-Aminoethyl)aniline 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: 81.0%

→ 2-(3-aminophenyl)ethylamine (76935-75-6)

Guidance literature:

Reference yield: 76.0%

2-(3-nitrophenyl)ethylamine (83304-13-6) → 2-(3-aminophenyl)ethylamine (76935-75-6)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In isopropyl alcohol; at 20 ℃; for 24h; Inert atmosphere;

DOI:10.1039/c0cc05282e

Reference yield:

N-(3-aminophenylmethyl)methylcarbamic acid t-butyl ester (180079-94-1) → 2-(3-aminophenyl)ethylamine (76935-75-6)

Guidance literature:

With trifluoroacetic acid; at 20 ℃; for 0.5h;

upstream raw materials:

3-nitro-β-nitrostyrene

2-(3-nitrophenyl)ethylamine

3-(3-benzoylamino-phenyl)-propionic acid

hydrogenchloride

Downstream raw materials:

tert-butyl (1-(3-aminophenyl)ethyl)carbamate

3-(2-aminoethyl)-N-(tert-butoxycarbonyl)phenylamine

3-(2-aminoethyl)-N-(9-fluorenylmethoxycarbonyl)phenylamine

methyl 3-(N-3-aminobenzyl-N-methyl)aminopropanoate