1-(3-Fluorophenyl)-2-thiourea

Base Information

Chemical Name:1-(3-Fluorophenyl)-2-thiourea
CAS No.:458-05-9
Molecular Formula:C7H7FN2S
Molecular Weight:170.21
Hs Code.:29309090
European Community (EC) Number:622-740-9
DSSTox Substance ID:DTXSID10370509
Nikkaji Number:J308.990H
Wikidata:Q82157661
ChEMBL ID:CHEMBL1477605
Mol file:458-05-9.mol

Synonyms:1-(3-Fluorophenyl)-2-thiourea;458-05-9;1-(3-fluorophenyl)thiourea;(3-Fluorophenyl)thiourea;3-fluorophenylthiourea;N-(3-fluorophenyl)thiourea;BlumenolB;1-(m-Fluorophenyl)thiourea;MLS000860257;SCHEMBL147446;CHEMBL1477605;(3-Fluorophenyl)thiourea, 97%;DTXSID10370509;YKOBLHQALWQKTC-UHFFFAOYSA-N;HMS2799H18;MFCD00041167;AKOS009140721;PS-8696;SMR000461036;CS-0212179;FT-0605626;FT-0615746;EN300-87363;D85867;A826898

Suppliers and Price of 1-(3-Fluorophenyl)-2-thiourea

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

TRC
1-(3-Fluorophenyl)-2-thiourea
500mg
$ 65.00

SynQuest Laboratories
3-Fluorophenylthiourea 98%
5 g
$ 28.00

SynQuest Laboratories
3-Fluorophenylthiourea 98%
25 g
$ 100.00

Sigma-Aldrich
(3-Fluorophenyl)thiourea 97%
5g
$ 110.00

Sigma-Aldrich
(3-Fluorophenyl)thiourea 97%
1g
$ 37.40

Matrix Scientific
1-(3-Fluorophenyl)-2-thiourea 98%
5g
$ 46.00

Atlantic Research Chemicals
1-(3-Fluorophenyl)-2-thiourea 95%
1gm:
$ 13.43

Apolloscientific
3-Fluorophenylthiourea 98%
25g
$ 90.00

Apolloscientific
3-Fluorophenylthiourea 98%
5g
$ 25.00

American Custom Chemicals Corporation
3-FLUOROPHENYLTHIOUREA 95.00%
5G
$ 1005.43

Total 32 raw suppliers

Chemical Property of 1-(3-Fluorophenyl)-2-thiourea

Chemical Property:

Appearance/Colour:almost white fine crystalline powder
Vapor Pressure:0.0131mmHg at 25°C
Melting Point:114-117 °C
Refractive Index:1.692
Boiling Point:259.3 °C at 760 mmHg
PKA:12.61±0.70(Predicted)
Flash Point:110.6 °C
PSA：70.14000
Density:1.397 g/cm³
LogP:2.25450
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:170.03139757
Heavy Atom Count:11
Complexity:151

Purity/Quality:

97% ^*data from raw suppliers

1-(3-Fluorophenyl)-2-thiourea ^*data from reagent suppliers

Safty Information:

Pictogram(s): T,Xi
Hazard Codes:T,Xi
Statements: 25-36/37/38
Safety Statements: 26-36-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC(=CC(=C1)F)NC(=S)N

Technology Process of 1-(3-Fluorophenyl)-2-thiourea

There total 8 articles about 1-(3-Fluorophenyl)-2-thiourea 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: 100.0%

: 404-72-8
3-fluorophenyl isothiocyanate

: 458-05-9
1-(3-fluorophenyl)thiourea

Guidance literature:: With ammonium hydroxide; In water; acetonitrile; at 20 ℃; for 3h;
DOI:10.1016/j.tetlet.2018.10.055

Reference yield: 91.0%

: 372-19-0
meta-fluoroaniline

: 1147550-11-5
ammonium thiocyanate

: 458-05-9
1-(3-fluorophenyl)thiourea

Guidance literature:: meta-fluoroaniline; ammonium thiocyanate; With benzoyl chloride; In acetone; for 1h; Heating;

With sodium hydroxide; for 1.5h; Further stages.; Heating;
DOI:10.1016/j.bmc.2006.08.026