5-Nitro-2-p-tolylsulfanyl-benzoic acid

Base Information

Chemical Name:5-Nitro-2-p-tolylsulfanyl-benzoic acid
CAS No.:78160-05-1
Molecular Formula:C₁₄H₁₁NO₄S
Molecular Weight:289.312
Hs Code.:2930909090
DSSTox Substance ID:DTXSID30368549
Wikidata:Q82155161
Mol file:78160-05-1.mol

Synonyms:78160-05-1;5-Nitro-2-p-tolylsulfanyl-benzoic acid;2-[(4-methylphenyl)sulfanyl]-5-nitrobenzoic acid;2-(4-methylphenyl)sulfanyl-5-nitrobenzoic acid;5-Nitro-2-(p-tolylthio)benzoic acid;5-NITRO-2-P-TOLYLSULFANYL-BENZOICACID;DTXSID30368549;5-Nitro-2-(p-tolylthio)benzoicacid;AKOS000117627;CS-0219907;EN300-05284;SR-01000040786;SR-01000040786-1;Z55985160

Suppliers and Price of 5-Nitro-2-p-tolylsulfanyl-benzoic acid

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

American Custom Chemicals Corporation
5-NITRO-2-P-TOLYLSULFANYL-BENZOIC ACID 95.00%
5G
$ 1295.03

American Custom Chemicals Corporation
5-NITRO-2-P-TOLYLSULFANYL-BENZOIC ACID 95.00%
2.5G
$ 1065.66

American Custom Chemicals Corporation
5-NITRO-2-P-TOLYLSULFANYL-BENZOIC ACID 95.00%
1G
$ 765.23

AK Scientific
5-Nitro-2-p-tolylsulfanyl-benzoicacid
100mg
$ 172.00

Total 4 raw suppliers

Chemical Property of 5-Nitro-2-p-tolylsulfanyl-benzoic acid

Chemical Property:

Vapor Pressure:5.73E-10mmHg at 25°C
Boiling Point:478.6°C at 760 mmHg
Flash Point:243.2°C
PSA：108.42000
Density:1.42g/cm3
LogP:4.27580
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:289.04087901
Heavy Atom Count:20
Complexity:363

Purity/Quality:

99% ^*data from raw suppliers

5-NITRO-2-P-TOLYLSULFANYL-BENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Technology Process of 5-Nitro-2-p-tolylsulfanyl-benzoic acid

There total 1 articles about 5-Nitro-2-p-tolylsulfanyl-benzoic acid 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:

: 2516-96-3
2-chloro-5-nitrobenzoic acid

: 106-45-6
para-thiocresol

: 78160-05-1
5-nitro-2-p-tolylsulfanyl-benzoic acid

Guidance literature:: With sodium hydroxide;

Reference yield: 85.0%

: 78160-05-1
5-nitro-2-p-tolylsulfanyl-benzoic acid

: 78160-07-3
5-Amino-2-p-tolylsulfanyl-benzoic acid

Guidance literature:: With hydrogenchloride; iron; 1) water, 90-95 deg C, 2) methanol, reflux, 3-4 h;

Reference yield:

: 78160-05-1
5-nitro-2-p-tolylsulfanyl-benzoic acid

: 78160-73-3
1-(4-Ethoxy-phenyl)-3-(7-methyl-9-oxo-9H-thioxanthen-2-yl)-thiourea

Guidance literature:: Multi-step reaction with 3 steps

1: 72 percent / conc. H₂SO₄ / 100 - 105 °C

2: 75 percent / stannous chloride, conc. HCl / acetic acid / Heating

3: 64 percent / propan-1-ol / 0.5 h / Heating

With hydrogenchloride; sulfuric acid; tin(ll) chloride; In propan-1-ol; acetic acid;