5-Amino-2-phenylsulfanyl-benzoic acid methyl ester

Base Information

Chemical Name:5-Amino-2-phenylsulfanyl-benzoic acid methyl ester
CAS No.:361336-73-4
Molecular Formula:C₁₄H₁₃NO₂S
Molecular Weight:259.329
Hs Code.:
DSSTox Substance ID:DTXSID50473806
Wikidata:Q82303440
Mol file:361336-73-4.mol

Synonyms:361336-73-4;5-AMINO-2-PHENYLSULFANYL-BENZOIC ACID METHYL ESTER;METHYL 5-AMINO-2-(PHENYLTHIO)BENZOATE;methyl 5-amino-2-phenylsulfanylbenzoate;methyl 5-amino-2-(phenylsulfanyl)benzoate;Methyl 5-amino-2-phenylsulfanyl-benzoate;DTXSID50473806;AB1503;MFCD06658472;AKOS010567814;SB36823;CS-0210674;FT-0707785;METHYL5-AMINO-2-(PHENYLTHIO)BENZOATE;EN300-7397714;A823134

Suppliers and Price of 5-Amino-2-phenylsulfanyl-benzoic acid methyl ester

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

Crysdot
Methyl5-amino-2-(phenylthio)benzoate 97%
1g
$ 545.00

Crysdot
Methyl5-amino-2-(phenylthio)benzoate 97%
5g
$ 1636.00

American Custom Chemicals Corporation
METHYL-5-AMINO-2-(PHENYLTHIO)BENZOATE 98.00%
0.25G
$ 710.00

American Custom Chemicals Corporation
METHYL-5-AMINO-2-(PHENYLTHIO)BENZOATE 98.00%
5MG
$ 495.88

AK Scientific
5-Amino-2-phenylsulfanyl-benzoicacidmethylester
250mg
$ 110.00

Total 5 raw suppliers

Chemical Property of 5-Amino-2-phenylsulfanyl-benzoic acid methyl ester

Chemical Property:

XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:259.06669983
Heavy Atom Count:18
Complexity:279

Purity/Quality:

97% ^*data from raw suppliers

Methyl5-amino-2-(phenylthio)benzoate 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 5-Amino-2-phenylsulfanyl-benzoic acid methyl ester

There total 5 articles about 5-Amino-2-phenylsulfanyl-benzoic acid methyl ester 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: 75.0%

: 361336-72-3
methyl 5-nitro-2-(phenylthio)benzoate

: 361336-73-4
methyl 5-amino-2-(phenylthio)benzoate

Guidance literature:: With iron; acetic acid; at 80 ℃;
DOI:10.1021/jm030233b

Reference yield:

: 7304-32-7
2-fluoro-5-nitrobenzoic acid

: 361336-73-4
methyl 5-amino-2-(phenylthio)benzoate

Guidance literature:: Multi-step reaction with 4 steps

1: 87 percent / Et₃N / tetrahydrofuran / 20 h / Heating

2: oxalyl chloride; DMF / CH₂Cl₂ / 20 °C

3: 4.21 g / pyridine / CH₂Cl₂ / 20 °C

4: 75 percent / Fe; glacial AcOH / 80 °C

With pyridine; oxalyl dichloride; iron; acetic acid; triethylamine; N,N-dimethyl-formamide; In tetrahydrofuran; dichloromethane;
DOI:10.1021/jm030233b

Reference yield:

: 6345-67-1
2-carboxy-4-nitrodiphenyl sulphide

: 361336-73-4
methyl 5-amino-2-(phenylthio)benzoate

Guidance literature:: Multi-step reaction with 3 steps

1: oxalyl chloride; DMF / CH₂Cl₂ / 20 °C

2: 4.21 g / pyridine / CH₂Cl₂ / 20 °C

3: 75 percent / Fe; glacial AcOH / 80 °C

With pyridine; oxalyl dichloride; iron; acetic acid; N,N-dimethyl-formamide; In dichloromethane;
DOI:10.1021/jm030233b