4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene

Base Information

• Chemical Name: 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene
• CAS No.: 78859-36-6
• Molecular Formula: C₁₃H₁₁N₅
• Molecular Weight: 237.264
• UNII: 2FT5LUT6WP
• DSSTox Substance ID: DTXSID501000088
• Nikkaji Number: J130.129B
• Mol file: 78859-36-6.mol

Synonyms:78859-36-6;4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene;Orn-P-1;2FT5LUT6WP;6H-2,5,6a,7-Tetraazafluoranthen-3-amine, 1-methyl-;4-AMINO-6-METHYL-2,5,10,10B-TETRAAZAFLUORANTHENE;8-methyl-1,3,7,14-tetrazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10(15),11,13-heptaen-6-amine;BRN 5755713;1-methyl-6h-2,5,6a,7-tetraazafluoranthen-3-amine;UNII-2FT5LUT6WP;ORN-P 1;1H-2,5,10,10b-Tetraazafluoranthene, 4-amino-6-methyl-;DTXSID501000088;1-Methyl-2,6-dihydro-3H-2,5,6a,7-tetraazafluoranthen-3-imine;4-AMINO-6-METHYL-1 H-2,5,10,10B-TETRAAZA-FLUORANTHENE

Chemical Property of 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene

Chemical Property:

• Vapor Pressure: 1.2E-07mmHg at 25°C
• Boiling Point: 431.4°C at 760 mmHg
• Flash Point: 214.7°C
• PSA: 69.09000
• Density: 1.59g/cm³
• LogP: 1.88190
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 237.10144537
• Heavy Atom Count: 18
• Complexity: 370

Purity/Quality:

99% ^*data from raw suppliers

Orn-P1 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C3=C(N=CC=C3)N4C2=C(C=NC4)C(=N1)N
• Uses: Orn-P 1 can be used in biological study for density functional study of relationship between structure and carcinogenicity/mutagenicity of heterocyclic aromatic amines.

Technology Process of 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene

There total 1 articles about 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene 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:

L-ornithine hydrochloride (3184-13-2,36630-89-4) → 4-amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene (78859-36-6)

Guidance literature:

pyrolyzed over a direct flame;

DOI:10.1248/cpb.29.1473

upstream raw materials:

L-ornithine hydrochloride