Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl-

Base Information

• Chemical Name: Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl-
• CAS No.: 19275-09-3
• Molecular Formula: C17H11 N3 O
• Molecular Weight: 0
• Hs Code.: 2933699090
• DSSTox Substance ID: DTXSID00940952
• Nikkaji Number: J109.615J
• Wikidata: Q82917718
• Mol file: 19275-09-3.mol

Synonyms:Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl-;19275-09-3;3-phenylbenzo[g][1,2,3]benzotriazin-4-one;Naphtho[2,3-d]-1,2,3-triazin-4(3H)-one, 3-phenyl-;3-Phenylnaphtho[2,3-d][1,2,3]triazin-4(3H)-one;Naphtho(2,3-e)-4-hydro-4-oxo-3-phenyl-1,2,3-triazine;Naphtho[2,3-e]-4-hydro-4-oxo-3-phenyl-1,2,3-triazine;DTXSID00940952;OHHFEIRDCKETFR-UHFFFAOYSA-N;Naphtho[2,3-d]-v-triazin-4(3H)-one,3-phenyl-

Chemical Property of Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl-

Chemical Property:

• Vapor Pressure: 5.54E-09mmHg at 25°C
• Boiling Point: 469.4°Cat760mmHg
• Flash Point: 237.7°C
• PSA: 47.78000
• Density: 1.3g/cm³
• LogP: 2.93390
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 273.090211983
• Heavy Atom Count: 21
• Complexity: 430

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N2C(=O)C3=CC4=CC=CC=C4C=C3N=N2

Technology Process of Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl-

There total 4 articles about Naphtho[2,3-d]-v-triazin-4(3H)-one, 3-phenyl- 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:

C18H15N3O2 → 3-phenyl-3H-naphtho[2,3-d][1,2,3]triazin-4-one (19275-09-3)

Guidance literature:

With morpholine; In ethanol; at 85 ℃;

DOI:10.1021/acs.orglett.0c01579

Reference yield:

Methyl 3-amino-2-naphthoate (21597-54-6) → 3-phenyl-3H-naphtho[2,3-d][1,2,3]triazin-4-one (19275-09-3)

Guidance literature:

Multi-step reaction with 2 steps

1.1: hydrogenchloride; sodium nitrite / water / 0.5 h / -5 °C

1.2: 3 h / -5 - 0 °C

2.1: morpholine / ethanol / 85 °C

With morpholine; hydrogenchloride; sodium nitrite; In ethanol; water;

DOI:10.1021/acs.orglett.0c01579

Reference yield:

→ 3-phenyl-3H-naphtho[2,3-d][1,2,3]triazin-4-one (19275-09-3)

Guidance literature:

3-Amino-2-naphthanilid, NaNO2/ HCl;

upstream raw materials:

Methyl 3-amino-2-naphthoate

aniline