N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine

Base Information

• Chemical Name: N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine
• CAS No.: 177962-28-6
• Molecular Formula: C₁₄H₁₈ClN₅
• Molecular Weight: 291.783
• DSSTox Substance ID: DTXSID401324631
• ChEMBL ID: CHEMBL1376503
• Mol file: 177962-28-6.mol

Synonyms:177962-28-6;N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine;4-N-benzyl-2-N-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine;N2-Benzyl-N4-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine;Oprea1_617108;C14H18ClN5;CBDivE_012970;MLS000767680;CHEMBL1376503;DTXSID401324631;HMS2776C20;STK012263;AKOS003672012;SMR000430014;SR-01000195169;SR-01000195169-1;N-Benzyl-N'-tert-butyl-6-chloro-[1,3,5]triazine-2,4-diamine;N-benzyl-N'-tert-butyl-6-chloro-1,3,5-triazine-2,4-diamine

Chemical Property of N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 291.1250733
• Heavy Atom Count: 20
• Complexity: 288

Purity/Quality:

95% ^*data from raw suppliers

N-BENZYL-N'-(TERT-BUTYL)-6-CHLORO-1,3,5-TRIAZINE-2,4-DIAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)NC1=NC(=NC(=N1)NCC2=CC=CC=C2)Cl

Technology Process of N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine

There total 2 articles about N-benzyl-N'-(tert-butyl)-6-chloro-1,3,5-triazine-2,4-diamine 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: 46.0%

2,4-dichloro-6-t-butylamino-1,3,5-triazine (27282-85-5) + benzylamine (100-46-9) → 2-Benzylamino-4-tert-butylamino-6-chloro-s-triazine (177962-28-6)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; water; at 20 ℃;

DOI:10.1002/(SICI)1096-9063(199606)47:2<145::AID-PS381>3.0.CO;2-0

Reference yield:

benzyl-(4,6-dichloro-[1,3,5]triazin-2-yl)amine (30369-82-5) + tert-butylamine (75-64-9) → 2-Benzylamino-4-tert-butylamino-6-chloro-s-triazine (177962-28-6)

Guidance literature:

at 20 ℃; for 12h;

Reference yield:

2-Benzylamino-4-tert-butylamino-6-chloro-s-triazine (177962-28-6) → C14H21N7

Guidance literature:

With hydrazine; In dichloromethane; water; at 60 ℃; for 12h;

upstream raw materials:

2,4-dichloro-6-t-butylamino-1,3,5-triazine

benzylamine

benzyl-(4,6-dichloro-[1,3,5]triazin-2-yl)amine

tert-butylamine