2-Methylphenyl isothiocyanate

Base Information

Chemical Name:2-Methylphenyl isothiocyanate
CAS No.:614-69-7
Molecular Formula:C8H7NS
Molecular Weight:149.216
Hs Code.:2930 90 98
European Community (EC) Number:210-390-6
NSC Number:220230
UNII:U0ST94Z07Y
DSSTox Substance ID:DTXSID60210325
Nikkaji Number:J134.610E
Mol file:614-69-7.mol

Synonyms:2-tolyl isothiocyanate;o-tolyl isothiocyanate

Suppliers and Price of 2-Methylphenyl isothiocyanate

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
o-Tolyl Isothiocyanate
500mg
$ 45.00

TCI Chemical
o-Tolyl Isothiocyanate >99.0%(GC)
5g
$ 18.00

TCI Chemical
o-Tolyl Isothiocyanate >99.0%(GC)
25g
$ 66.00

SynQuest Laboratories
2-Methylphenyl isothiocyanate 99%
1 g
$ 21.00

SynQuest Laboratories
2-Methylphenyl isothiocyanate 99%
5 g
$ 41.00

SynQuest Laboratories
2-Methylphenyl isothiocyanate 99%
25 g
$ 159.00

Sigma-Aldrich
2-Methylphenyl isothiocyanate for synthesis
5 mL
$ 123.00

Sigma-Aldrich
2-Methylphenyl isothiocyanate for synthesis. CAS 614-69-7, chemical formula 2(CH )C H NCS., for synthesis
8187380005
$ 119.00

Matrix Scientific
2-Tolyl isothiocyanate 99%
5g
$ 17.00

Matrix Scientific
2-Tolyl isothiocyanate 99%
25g
$ 68.00

Total 55 raw suppliers

Chemical Property of 2-Methylphenyl isothiocyanate

Chemical Property:

Appearance/Colour:clear yellow liquid
Vapor Pressure:0.0634mmHg at 25°C
Melting Point:236 °C
Refractive Index:1.6351-1.6371
Boiling Point:239 °C at 760 mmHg
Flash Point:107 °C
PSA：44.45000
Density:1.115
LogP:2.72930
Storage Temp.:Store below +30°C.
Sensitive.:Moisture Sensitive
Solubility.:Chloroform (Slightly), Methanol (Slightly)
Water Solubility.:MAY DECOMPOSE
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:149.02992040
Heavy Atom Count:10
Complexity:149

Purity/Quality:

97% ^*data from raw suppliers

o-Tolyl Isothiocyanate ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn,T
Hazard Codes:Xn,T
Statements: 42/43-20/21/22-36/37/38
Safety Statements: 45-36/37/39-26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CC=CC=C1N=C=S
Uses Ethyl Carbitol Acetate has a wide varaity of applications as it is used in surfactants, films and resins.

Technology Process of 2-Methylphenyl isothiocyanate

There total 52 articles about 2-Methylphenyl isothiocyanate 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: 99.0%

: 785-49-9
o-phenyl o-tolylcarbamothioate

: 614-69-7
2-tolyl isothiocyanate

Guidance literature:: With sodium hydroxide; In dichloromethane; at 20 ℃; for 1h;
DOI:10.1055/s-0033-1338744

Reference yield: 95.0%

: 75-15-0,12122-00-8
carbon disulfide

: 95-53-4
o-toluidine

: 614-69-7
2-tolyl isothiocyanate

Guidance literature:: carbon disulfide; o-toluidine; With potassium carbonate; In water; at 20 ℃; for 3h; Inert atmosphere;

With 1,3,5-trichloro-2,4,6-triazine; In dichloromethane; water; at 0 ℃; for 0.5h; Inert atmosphere;

With sodium hydroxide; In dichloromethane; water; pH=11; Inert atmosphere;
DOI:10.3762/bjoc.8.6

Reference yield: 94.0%

: 74467-03-1
N-hydroxy-2-methylbenzenecarboximidoyl chloride

: 614-69-7
2-tolyl isothiocyanate

Guidance literature:: With OuadraPure Thiaurea resin; SIO₂-pyridine; In acetonitrile; at 50 ℃; for 0.166667h; Flow reactor;
DOI:10.3762/bjoc.9.184