2-Methyl-5-chloro-6-benzoxazolamine

Base Information

• Chemical Name: 2-Methyl-5-chloro-6-benzoxazolamine
• CAS No.: 323579-00-6
• Molecular Formula: C₈H₇ClN₂O
• Molecular Weight: 182.609
• Hs Code.: 2934999090
• European Community (EC) Number: 608-731-2
• DSSTox Substance ID: DTXSID30460835
• Wikidata: Q72489143
• Mol file: 323579-00-6.mol

Synonyms:2-Methyl-5-chloro-6-benzoxazolamine;323579-00-6;5-Chloro-2-methyl-1,3-benzoxazol-6-amine;6-Benzoxazolamine, 5-chloro-2-methyl-;5-chloro-2-methylbenzo[d]oxazol-6-amine;SCHEMBL5857975;DTXSID30460835;VZICVFYCZDSEFK-UHFFFAOYSA-N;YMA57900;MFCD07368636;AKOS006287480;CS-W021723;s10266;TS-02545;A821242

Chemical Property of 2-Methyl-5-chloro-6-benzoxazolamine

Chemical Property:

• Appearance/Colour: brown crystal powder
• Vapor Pressure: 0.000783mmHg at 25°C
• Melting Point: 202-203 °C
• Refractive Index: 1.667
• Boiling Point: 306.21 °C at 760 mmHg
• PKA: 1.10±0.10(Predicted)
• Flash Point: 138.991 °C
• PSA: 52.05000
• Density: 1.404 g/cm³
• LogP: 2.95300
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 182.0246905
• Heavy Atom Count: 12
• Complexity: 178

Purity/Quality:

98%, ^*data from raw suppliers

2-Methyl-5-chloro-6-benzoxazolamine 95%-98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(O1)C=C(C(=C2)Cl)N

Technology Process of 2-Methyl-5-chloro-6-benzoxazolamine

There total 3 articles about 2-Methyl-5-chloro-6-benzoxazolamine 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:

5-chloro-2-methyl-6-nitrobenzoxazole (13452-16-9) → 5-chloro-2-methyl-benzoxazol-6-ylamine (323579-00-6)

Guidance literature:

With iron; acetic acid; at 80 ℃;

Reference yield:

5-chloro-2-methyl-6-nitrobenzoxazole (13452-16-9) + acetic acid (64-19-7,77671-22-8) → 5-chloro-2-methyl-benzoxazol-6-ylamine (323579-00-6)

Guidance literature:

Reference yield:

→ 5-chloro-2-methyl-benzoxazol-6-ylamine (323579-00-6)

Guidance literature:

upstream raw materials:

5-chloro-2-methyl-6-nitrobenzoxazole

acetic acid

Refernces

• 1、 -. "Photographic element, compound, and process". . . Retrieved 2008/06/13.
• 2、 -. "Photographic element, compound, and process". . . Retrieved 2008/06/13.