Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester

Base Information

Chemical Name:Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester
CAS No.:109226-94-0
Molecular Formula:C₁₇H₁₅N₃O₅
Molecular Weight:341.323
Hs Code.:
DSSTox Substance ID:DTXSID90148844
Wikidata:Q83014495

Synonyms:BRN 6002241;Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester;109226-94-0;Methyl 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)benzeneacetate;DTXSID90148844;LS-28966

Suppliers and Price of Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester

Chemical Property:

Vapor Pressure:1.45E-12mmHg at 25°C
Boiling Point:559.9°C at 760 mmHg
Flash Point:292.4°C
Density:1.39g/cm³
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:341.10117059
Heavy Atom Count:25
Complexity:525

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC1=CC=C(C=C1)NC2=NC3=C(C=CC(=C3)[N+](=O)[O-])OC2

Technology Process of Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester

There total 2 articles about Benzeneacetic acid, 4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester 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: 74.0%

: 39552-81-3
methyl p-aminophenylacetate

: 109226-90-6
3-methylthio-6-nitro-2H-1,4-benzoxazine

: 109226-94-0
methyl 4-<6-nitro-2H-1,4-benzoxazin-3-yl>aminophenylacetate

Guidance literature:: In ethanol; Heating;

Reference yield:

: 81912-93-8
6-nitro-2H-benzo[b][1,4]oxazine-3(4H)-thione

: 109226-94-0
methyl 4-<6-nitro-2H-1,4-benzoxazin-3-yl>aminophenylacetate

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / K₂CO₃ / acetone / Heating

2: 74 percent / ethanol / Heating

With potassium carbonate; In ethanol; acetone;