alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene

Base Information Edit

Chemical Name:alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene
CAS No.:346-44-1
Molecular Formula:C13H8 F3 N O2 S
Molecular Weight:299.273
Hs Code.:2930909090
European Community (EC) Number:206-470-5
DSSTox Substance ID:DTXSID70188167
Nikkaji Number:J193.801K
Wikidata:Q83059985
Mol file:346-44-1.mol

Synonyms:346-44-1;alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene;2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene;2-nitro-1-phenylsulfanyl-4-(trifluoromethyl)benzene;Benzene,2-nitro-1-(phenylthio)-4-(trifluoromethyl)-;2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide;(2-nitro-4-(trifluoromethyl)phenyl)(phenyl)sulfane;EINECS 206-470-5;Benzene, 1-trifluoromethyl-3-nitro-4-phenylthio-;C13H8F3NO2S;SCHEMBL11709219;DTXSID70188167;C13-H8-F3-N-O2-S;MFCD02648645;STK764190;AKOS001742377;3-nitro-4-(phenylthio)-benzotrifluoride;CS-0362851;EU-0019251;2-Nitro-4-(trifluoromethyl)phenylphenyl sulfide;SR-01000531932;11T-0633;2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide #;SR-01000531932-1;Benzene, 2-nitro-1-(phenylthio)-4-(trifluoromethyl)-

Suppliers and Price of alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene

Supply Marketing:Edit

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

Matrix Scientific
2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide
10mg
$ 146.00

Matrix Scientific
2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide
5mg
$ 105.00

Matrix Scientific
2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide
1mg
$ 90.00

Total 6 raw suppliers

Chemical Property of alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene Edit

Chemical Property:

Boiling Point:345.8°Cat760mmHg
Flash Point:162.9°C
PSA：71.12000
Density:1.44g/cm³
LogP:5.28800
XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:299.02278416
Heavy Atom Count:20
Complexity:340

Purity/Quality:

98%min ^*data from raw suppliers

2-Nitro-4-(trifluoromethyl)phenyl phenyl sulfide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Technology Process of alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene

There total 6 articles about alpha,alpha,alpha-Trifluoro-3-nitro-4-(phenylthio)toluene 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: 97.0%

: 108-98-5
thiophenol

: 121-17-5
2-chloro-3-nitro-5-trifluoromethylbenzene

: 346-44-1
(2-nitro-4-(trifluoromethyl)phenyl)phenylthioether

Guidance literature:: With ethylenediamine; copper(l) chloride; In water; at 120 ℃; for 36h; Inert atmosphere;
DOI:10.1016/j.tet.2008.11.062

Reference yield: 97.0%

: 367-86-2
1-fluoro-2-nitro-4-trifluoromethyl-benzene

: 108-98-5
thiophenol

: 346-44-1
(2-nitro-4-(trifluoromethyl)phenyl)phenylthioether

Guidance literature:: With copper(ll) sulfate pentahydrate; sodium carbonate; sodium L-ascorbate; L-proline; In water; dimethyl sulfoxide; at 70 ℃; for 12h;
DOI:10.1016/j.tet.2010.07.032