Cefotiam hexetil

Base Information

Chemical Name:Cefotiam hexetil
CAS No.:95761-91-4
Molecular Formula:C27H37 N9 O7 S3
Molecular Weight:695.845
Hs Code.:
UNII:J92A81Y99T
DSSTox Substance ID:DTXSID20914817
Nikkaji Number:J242.995K
Wikidata:Q27126537
NCI Thesaurus Code:C98226
Metabolomics Workbench ID:60477
ChEMBL ID:CHEMBL3137675
Mol file:95761-91-4.mol

Synonyms:cefotiam hexetil;cefotiam hexetil hydrochloride;cefotiam hexetil, (6R-(3(R*),6alpha,7beta))-isomer;cefotiam hexetil, (6R-(3(S*),6alpha,7beta))-isomer;cefotiam hexetil, (6R-(6alpha,7beta))-isomer

Suppliers and Price of Cefotiam hexetil

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
CEFOTIAM HEXETIL 95.00%
5MG
$ 495.72

Total 17 raw suppliers

Chemical Property of Cefotiam hexetil

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：280.05000
Density:1.63g/cm³
LogP:2.34560
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:16
Exact Mass:695.19780807
Heavy Atom Count:46
Complexity:1160

Purity/Quality:

99% ^*data from raw suppliers

CEFOTIAM HEXETIL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(OC(=O)C1=C(CSC2N1C(=O)C2NC(=O)CC3=CSC(=N3)N)CSC4=NN=NN4CCN(C)C)OC(=O)OC5CCCCC5
Isomeric SMILES:CC(OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)CC3=CSC(=N3)N)CSC4=NN=NN4CCN(C)C)OC(=O)OC5CCCCC5

Technology Process of Cefotiam hexetil

There total 6 articles about Cefotiam hexetil 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: 99.6%

: cefotiam sodium

: 95789-69-8,102672-57-1
cyclohexyl (1-iodoethyl)carbonate

: 95761-91-4
cefotiam hexetil

Guidance literature:: With sodium carbonate; In acetic acid butyl ester; at 6 ℃; Green chemistry;

Reference yield: 99.5%

: cefotiam potassium

: 95789-69-8,102672-57-1
cyclohexyl (1-iodoethyl)carbonate

: 95761-91-4
cefotiam hexetil

Guidance literature:: With potassium carbonate; In ethyl acetate; at 20 ℃; Green chemistry;

Reference yield:

: cefotiam Hydrochloride

: 95789-69-8,102672-57-1
cyclohexyl (1-iodoethyl)carbonate

: 95761-91-4
cefotiam hexetil

Guidance literature:: cefotiam Hydrochloride; With potassium hydrogencarbonate; In N,N-dimethyl acetamide; water; at 30 - 35 ℃; for 2h;

cyclohexyl (1-iodoethyl)carbonate; With sodium dithionite; In N,N-dimethyl acetamide; water; at -17 - -13 ℃; for 1h;