2-Butoxy-4,6-dichloro-1,3,5-triazine

Base Information

• Chemical Name: 2-Butoxy-4,6-dichloro-1,3,5-triazine
• CAS No.: 13838-32-9
• Molecular Formula: C7H9 Cl2 N3 O
• Molecular Weight: 222.074
• European Community (EC) Number: 237-555-5
• DSSTox Substance ID: DTXSID50160648
• Nikkaji Number: J280.329A
• Wikidata: Q83029003
• Mol file: 13838-32-9.mol

Synonyms:2-Butoxy-4,6-dichloro-1,3,5-triazine;13838-32-9;EINECS 237-555-5;C7H9Cl2N3O;2-n-Butoxy-4,6-dichloro-1,3,5-triazine;n-Butoxydichloro-S-triazine;SCHEMBL1318906;C7-H9-Cl2-N3-O;DTXSID50160648;MFCD00051826;AKOS009462418;SB73727;6-butoxy-2,4-dichloro-1,3,5-triazine;1,3,5-Triazine, 2-butoxy-4,6-dichloro-;2-n-Butoxy-4,6-dichloro-1,3,5--triazine;A908164

Chemical Property of 2-Butoxy-4,6-dichloro-1,3,5-triazine

Chemical Property:

• Vapor Pressure: 5.6E-05mmHg at 25°C
• Boiling Point: 357.5°Cat760mmHg
• Flash Point: 170°C
• PSA: 47.90000
• Density: 1.333g/cm³
• LogP: 2.35730
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 221.0122673
• Heavy Atom Count: 13
• Complexity: 140

Purity/Quality:

97% ^*data from raw suppliers

2-Butoxy-4,6-dichloro-1,3,5-triazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC1=NC(=NC(=N1)Cl)Cl

Technology Process of 2-Butoxy-4,6-dichloro-1,3,5-triazine

There total 2 articles about 2-Butoxy-4,6-dichloro-1,3,5-triazine 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: 85.0%

1,3,5-trichloro-2,4,6-triazine (108-77-0) + butan-1-ol (71-36-3) → 1-butyloxy-3,5-dichloro-2,4,6-triazine (13838-32-9)

Guidance literature:

With 2,4,6-trimethyl-pyridine; In acetone; for 1h; Cooling with ice;

DOI:10.1021/jo102483x

Reference yield:

→ 1-butyloxy-3,5-dichloro-2,4,6-triazine (13838-32-9)

Guidance literature:

/BRN= 135423/;

Reference yield: 75.0%

N-[3-(N-tert-butoxycarbonyl-hydrazino)-phenyl]-hydrazinecarboxylic acid tert-butyl ester (890041-18-6) + 1-butyloxy-3,5-dichloro-2,4,6-triazine (13838-32-9) → C30H42Cl2N10O6

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 0 - 20 ℃; for 4h;

DOI:10.1021/acs.joc.8b00284

upstream raw materials:

1,3,5-trichloro-2,4,6-triazine

butan-1-ol

Downstream raw materials:

C₄₂H₄₂Cl₃N₁₅O₃

2,4,6-tri(4-(4-butyloxy-6-chloro-1,3,5-triazin-2-yl)phenyl)-1,3,5-triazine

1,3,5-tri(4-(4-butyloxy-6-chloro-1,3,5-triazin-2-yl)oxyphenyl)benzene

6-(4-phenylphenyl)-1,3,5-triazine-2,4-diol