3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine

Base Information

Chemical Name:3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine
CAS No.:66548-69-4
Molecular Formula:C13H9F3N4
Molecular Weight:278.236
Hs Code.:
European Community (EC) Number:636-288-5
UNII:O7GR5XL5B5
DSSTox Substance ID:DTXSID80216728
Nikkaji Number:J22.059K
Wikipedia:CL-218,872
Wikidata:Q5012653
Pharos Ligand ID:K15ZYN732VF2
ChEMBL ID:CHEMBL13662

Synonyms:3-methyl-6-(3-(trifluoromethyl)phenyl)-1,2,4-triazolo(4,2-b)pyridazine;CL 218,872;CL 218872;CL-218872;CL218,872

Suppliers and Price of 3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
CL 218872
10mg
$ 339.00

TRC
CL218872
10mg
$ 45.00

Tocris
CL218872 ≥98%(HPLC)
10
$ 91.00

ApexBio Technology
CL218872
10mg
$ 156.00

American Custom Chemicals Corporation
3-METHYL-6-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLO-(4,3-B)PYRIDAZINE 95.00%
1G
$ 769.65

AHH
3-Methyl-6-[3-(trifluoromethyl)phenyl]-1,2,4-triazolo-(4,3-b)pyridazine 98%
0.05g
$ 300.00

Total 48 raw suppliers

Chemical Property of 3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine

Chemical Property:

Melting Point:193-194 °C(Solv: methanol (67-56-1))
Boiling Point:°Cat760mmHg
PKA:0.48±0.30(Predicted)
Flash Point:°C
PSA：43.08000
Density:1.43g/cm³
LogP:3.11850
Storage Temp.:2-8°C
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:278.07793079
Heavy Atom Count:20
Complexity:349

Purity/Quality:

98%,99%, ^*data from raw suppliers

CL 218872 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NN=C2N1N=C(C=C2)C3=CC(=CC=C3)C(F)(F)F
Uses CL 218872 is a useful research chemical.CL 218872 is a putative anxiolytic. CL 218872 is a benzodiazepine receptor (BZR) partial agonist and a putative anxiolytic.

Technology Process of 3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine

There total 6 articles about 3-Methyl-6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine 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:

: 1068-57-1
acetic acid hydrazide

: 66548-63-8
6-(α,α,α-trifluoro-m-tolyl)-3-chloropyridazine

: 71-36-3
butan-1-ol

: 66548-69-4
3-methyl-6-[3-(trifluoromethyl)phenyl]-1,2,4-triazolo[4,3-b]pyridazine

Guidance literature:: In ethanol;

Reference yield:

: 349-76-8
3'-(trifluoromethyl)acetophenone

: 66548-69-4
3-methyl-6-[3-(trifluoromethyl)phenyl]-1,2,4-triazolo[4,3-b]pyridazine

Guidance literature:: Multi-step reaction with 3 steps

1: 1.5135 g / p-toluenesulfonic acid / toluene / 44 h / Heating

2: 0.72 percent / tetrahydrofuran / 16 h / 23 °C

3: acetic acid / 19 h / Heating

With toluene-4-sulfonic acid; In tetrahydrofuran; acetic acid; toluene;