4-(Phenylthio)benzoic acid

Base Information

Chemical Name:4-(Phenylthio)benzoic acid
CAS No.:6310-24-3
Molecular Formula:C13H10O2S
Molecular Weight:230.287
Hs Code.:2930909090
European Community (EC) Number:621-707-6
NSC Number:43054
UNII:SZ9U5B968X
DSSTox Substance ID:DTXSID60212440
Nikkaji Number:J3.049.071A
Wikidata:Q83087567
Mol file:6310-24-3.mol

Synonyms:4-(Phenylthio)benzoic acid;6310-24-3;4-phenylsulfanylbenzoic acid;4-(phenylsulfanyl)benzoic acid;NSC43054;4-(Phenylthio)benzoicacid;NSC-43054;benzoic acid, 4-(phenylthio)-;benzoic acid,4-(phenylthio);NSC 43054;SCHEMBL689927;Benzoic acid, p-(phenylthio)-;SZ9U5B968X;DTXSID60212440;WRZVDYSYXLKRNN-UHFFFAOYSA-N;AR3146;MFCD00496602;AKOS003235711;AS-45534;CS-0171415;FT-0750932;EN300-7396260;A914862;AO-080/33510034

Suppliers and Price of 4-(Phenylthio)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

TRC
4-(Phenylthio)benzoicAcid
50mg
$ 130.00

Matrix Scientific
4-(Phenylthio)benzoic acid
0.500g
$ 120.00

Matrix Scientific
4-(Phenylthio)benzoic acid
1g
$ 150.00

Crysdot
4-(PHENYLTHIO)BENZOICACID 95+%
5g
$ 349.00

AstaTech
4-(PHENYLTHIO)BENZOICACID 95%
0.25 / G
$ 198.00

AstaTech
4-(PHENYLTHIO)BENZOICACID 95%
1 / G
$ 495.00

American Custom Chemicals Corporation
4-(PHENYLTHIO)BENZOIC ACID 95.00%
5G
$ 2837.84

American Custom Chemicals Corporation
4-(PHENYLTHIO)BENZOIC ACID 95.00%
1G
$ 1152.11

American Custom Chemicals Corporation
4-(PHENYLTHIO)BENZOIC ACID 95.00%
100MG
$ 691.27

AK Scientific
4-(Phenylthio)benzoicacid
500mg
$ 578.00

Total 7 raw suppliers

Chemical Property of 4-(Phenylthio)benzoic acid

Chemical Property:

Vapor Pressure:7.09E-08mmHg at 25°C
Boiling Point:422°Cat760mmHg
Flash Point:209°C
PSA：62.60000
Density:1.31g/cm³
LogP:3.53600
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:230.04015073
Heavy Atom Count:16
Complexity:228

Purity/Quality:

97% ^*data from raw suppliers

4-(Phenylthio)benzoicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)O

Technology Process of 4-(Phenylthio)benzoic acid

There total 26 articles about 4-(Phenylthio)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: 96.0%

: 40730-41-4
methyl 4-(phenylthio)benzoate

: 6310-24-3
4-(phenylthio)benzoic acid

Guidance literature:: With lithium hydroxide monohydrate; water; In tetrahydrofuran; methanol; at 20 ℃; for 4h;

Reference yield: 94.0%

: 586-76-5
4-Bromobenzoic acid

: 108-98-5
thiophenol

: 6310-24-3
4-(phenylthio)benzoic acid

Guidance literature:: With tetra(n-butyl)ammonium hydroxide; In water; at 80 ℃; for 48h; chemoselective reaction; Inert atmosphere; Sealed tube;
DOI:10.1039/c2ob06795a

Reference yield: 92.0%

: 3058-39-7
4-iodobenzonitrile

: 108-98-5
thiophenol

: 6310-24-3
4-(phenylthio)benzoic acid

Guidance literature:: With 4,4’‐bis(trimethylammoniummethyl)‐2,2’‐bipyridine; iron(III) chloride hexahydrate; potassium hydroxide; In water; for 24h; Reflux;
DOI:10.1039/b820790a