2-(1,3-Oxazol-5-yl)aniline

Base Information

• Chemical Name: 2-(1,3-Oxazol-5-yl)aniline
• CAS No.: 774238-36-7
• Molecular Formula: C9H8 N2 O
• Molecular Weight: 160.175
• Hs Code.: 2934999090
• European Community (EC) Number: 692-402-3
• DSSTox Substance ID: DTXSID20428146
• Wikidata: Q82240933
• Mol file: 774238-36-7.mol

Synonyms:2-(1,3-oxazol-5-yl)aniline;774238-36-7;2-(5-Oxazolyl)aniline;2-(Oxazol-5-yl)aniline;Benzenamine, 2-(5-oxazolyl)-;MFCD07772822;2-(Oxazol-5-yl)phenylamine;SCHEMBL4457202;DTXSID20428146;UZPQWOKKMYUKNI-UHFFFAOYSA-N;ZFB23836;AKOS006343734;AS-5457;SY012504;CS-0206997;FT-0644872;EN300-7361371;J-506519;J9Q

Chemical Property of 2-(1,3-Oxazol-5-yl)aniline

Chemical Property:

• Melting Point: 54 °C
• PSA: 52.05000
• LogP: 2.50500
• Storage Temp.: 2-8°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 160.063662883
• Heavy Atom Count: 12
• Complexity: 152

Purity/Quality:

97% ^*data from raw suppliers

2-(5-Oxazolyl)aniline ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=CN=CO2)N

Technology Process of 2-(1,3-Oxazol-5-yl)aniline

There total 3 articles about 2-(1,3-Oxazol-5-yl)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: 68.0%

5-(2-nitrophenyl)-1,3-oxazole (89808-75-3) → 2-(oxazol-5-yl)aniline (774238-36-7)

Guidance literature:

With hydrogenchloride; iron; In methanol; water; at 60 ℃; for 8h;

DOI:10.1039/c4ob02224f

Reference yield:

2-nitro-benzaldehyde (552-89-6) → 2-(oxazol-5-yl)aniline (774238-36-7)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / methanol / 6 h / Reflux

2: iron; hydrogenchloride / methanol; water / 8 h / 60 °C

With hydrogenchloride; iron; potassium carbonate; In methanol; water;

DOI:10.1039/c4ob02224f

Reference yield:

→ 2-(oxazol-5-yl)aniline (774238-36-7)

Guidance literature:

upstream raw materials:

5-(2-nitrophenyl)-1,3-oxazole

2-nitro-benzaldehyde

Downstream raw materials:

2,3-dichloro-N-(2-(oxazol-5-yl)phenyl)benzenesulfonamide