(S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate

Base Information Edit

Chemical Name:(S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate
CAS No.:243984-10-3
Molecular Formula:C15H17ClFNO4S
Molecular Weight:361.81600
Hs Code.:
ChEMBL ID:CHEMBL2096879
DSSTox Substance ID:DTXSID50468353
Nikkaji Number:J2.258.882F
Mol file:243984-10-3.mol

Synonyms:243984-10-3;TAK-242 S enantiomer;TAK-242 (S enantiomer);(S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate;AK-242 S enantiomer;ethyl (6S)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylate;1-Cyclohexene-1-carboxylic acid, 6-[[(2-chloro-4-fluorophenyl)aMino]sulfonyl]-, ethyl ester, (6S)-;TAK242 (S enantiomer);TAK 242 (S enantiomer);SCHEMBL1821271;CHEMBL2096879;Resatorvid (S enantiomer);DTXSID50468353;BCP13072;EX-A3638;MFCD16039229;CS-1214;HY-75017;F70814;A934529;(S)-ethyl6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate;(6S)-6-[[(2-Chloro-4-fluorophenyl)amino]sulfonyl]-1-cyclohexene-1-carboxylic acid ethyl ester

Suppliers and Price of (S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate

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

Ambeed
(S)-Ethyl6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate 98+%
1g
$ 441.00

Total 5 raw suppliers

Chemical Property of (S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate Edit

Chemical Property:

Melting Point:54-55℃
Boiling Point:462.0±55.0 °C(Predicted)
PKA:7.08±0.40(Predicted)
PSA：80.85000
Density:1.39
LogP:4.41660
Storage Temp.:2-8°C
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:361.0550851
Heavy Atom Count:23
Complexity:560

Purity/Quality:

98% ^*data from raw suppliers

(S)-Ethyl6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate 98+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=CCCCC1S(=O)(=O)NC2=C(C=C(C=C2)F)Cl
Isomeric SMILES:CCOC(=O)C1=CCCC[C@@H]1S(=O)(=O)NC2=C(C=C(C=C2)F)Cl

Technology Process of (S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate

There total 36 articles about (S)-ethyl 6-(N-(2-chloro-4-fluorophenyl)sulfamoyl)cyclohex-1-enecarboxylate 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: 72.0%