O-Phenyl chlorothioformate

Base Information Edit

Chemical Name:O-Phenyl chlorothioformate
CAS No.:1005-56-7
Molecular Formula:C7H5ClOS
Molecular Weight:172.635
Hs Code.:29309070
European Community (EC) Number:213-736-4
NSC Number:99103
DSSTox Substance ID:DTXSID40143349
Nikkaji Number:J113.588K
Mol file:1005-56-7.mol

Synonyms:1005-56-7;O-Phenyl Carbonochloridothioate;O-Phenyl chlorothioformate;Phenyl chlorothionocarbonate;Phenyl chlorothionoformate;O-phenyl chloromethanethioate;O-Phenyl chlorothionoformate;Carbonochloridothioic acid, O-phenyl ester;Phenyl thioxochloroformate;Chlorothioformic acid phenyl ester;Phenyl thionochloroformate;Phenoxythiocarbonyl chloride;C7H5ClOS;phenyl chloromethanethioate;EINECS 213-736-4;Formic acid, chlorothio-, O-phenyl ester;O-Phenyl Chlorothiocarbonate;Chlorothioformic Acid O-Phenyl Ester;PhOCSCl;MFCD00004920;NSC 99103;phenylchlorothiocarbonate;henyl chlorothionocarbonate;2-Phenyl chlorothionoformate;NCIOpen2_001921;Formic acid, O-phenyl ester;phenyloxythiocarbonyl chloride;SCHEMBL19247;O-PhenylCarbonochloridothioate;o-Phenyl chloridothiocarbonate #;DTXSID40143349;O-Phenyl chlorothionoformate, 99%;BCP10334;NSC99103;NSC-99103;AKOS000216107;CS-W008892;DS-8005;FT-0633236;P1236;EN300-125109;A800235;J-000164;O-Phenyl chlorothionoformate, purum, >=99.0% (AT)

Suppliers and Price of O-Phenyl chlorothioformate

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

TRC
Phenyl Chlorothionoformate
50g
$ 480.00

TCI Chemical
Phenyl Chlorothionoformate >98.0%(GC)(T)
25g
$ 90.00

TCI Chemical
Phenyl Chlorothionoformate >98.0%(GC)(T)
5g
$ 29.00

Sigma-Aldrich
O-Phenyl chlorothionoformate 99%
1g
$ 27.50

Sigma-Aldrich
O-Phenyl chlorothionoformate 99%
5g
$ 80.60

Oakwood
O-Phenyl chlorothionoformate
100g
$ 255.00

Oakwood
O-Phenyl chlorothionoformate
25g
$ 85.00

Oakwood
O-Phenyl chlorothionoformate
1g
$ 10.00

Oakwood
O-Phenyl chlorothionoformate
5g
$ 24.00

Medical Isotopes, Inc.
Phenyl Chlorothionoformate
10 g
$ 650.00

Total 89 raw suppliers

Chemical Property of O-Phenyl chlorothioformate Edit

Chemical Property:

Appearance/Colour:clear yellow liquid
Vapor Pressure:0.166mmHg at 25°C
Melting Point:51 °C
Refractive Index:n20/D 1.581(lit.)
Boiling Point:220.612 °C at 760 mmHg
Flash Point:87.223 °C
PSA：41.32000
Density:1.33 g/cm³
LogP:2.58910
Storage Temp.:0-6°C
Sensitive.:Moisture Sensitive
Solubility.:Chloroform, Ethyl Acetate
Water Solubility.:decomposes
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:171.9749636
Heavy Atom Count:10
Complexity:121

Purity/Quality:

98% ^*data from raw suppliers

Phenyl Chlorothionoformate ^*data from reagent suppliers

Safty Information:

Pictogram(s): C
Hazard Codes:C
Statements: 34
Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)OC(=S)Cl
Uses Phenyl Chlorothionoformate is used in the preparation of an bicyclic thymidine analogs as selective inhibitors of Thymidine monophosphate kinase Mycobacterium tuberculosis (TMPKmt). O-Phenyl chlorothionoformate has been used in:stereodirected synthesis of optically active, (?)-mintlactonesynthesis of peptide α-thioesters having a variety of C-terminal amino acidssynthesis of scyllo-inositol derivativesthionocarbonylation of unprotected thymine nucleosidespreparation of phenoxythiocarbonyl esters of protected ribonucleosides

Technology Process of O-Phenyl chlorothioformate

There total 4 articles about O-Phenyl chlorothioformate 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%