6-Iodopenicillanic acid

Base Information

Chemical Name:6-Iodopenicillanic acid
CAS No.:74772-32-0
Molecular Formula:C₈H₁₀INO₃S
Molecular Weight:327.143
Hs Code.:
UNII:DXM035IT0F
DSSTox Substance ID:DTXSID80996290
Nikkaji Number:J1.058.019F
Wikidata:Q27276663
Mol file:74772-32-0.mol

Synonyms:6-beta-iodopenicillanate;6-beta-iodopenicillanic acid;6-iodopenicillanic acid;6-iodopenicillanic acid, potassium salt, (2S-(2alpha,5alpha,6beta))-isomer;UK-38,006

Suppliers and Price of 6-Iodopenicillanic 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

Total 4 raw suppliers

Chemical Property of 6-Iodopenicillanic acid

Chemical Property:

Vapor Pressure:1.12E-10mmHg at 25°C
Boiling Point:483.5°C at 760 mmHg
Flash Point:246.2°C
Density:2.06g/cm³
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:326.94261
Heavy Atom Count:14
Complexity:320

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(N2C(S1)C(C2=O)I)C(=O)O)C
Isomeric SMILES:CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)I)C(=O)O)C

Technology Process of 6-Iodopenicillanic acid

There total 6 articles about 6-Iodopenicillanic 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:

: 76517-36-7
6-β-iodopenicillanic acid benzhydryl ester

: 74772-32-0
6β-iodopenicillanic acid

Guidance literature:: With trifluoroacetic acid; In dichloromethane;

Reference yield:

: 75722-79-1
4-methoxybenzyl 6β-iodopenicillanate

: 74772-32-0
6β-iodopenicillanic acid

Guidance literature:: With trifluoroacetic acid; In dichloromethane; for 0.666667h; Ambient temperature;
DOI:10.1016/0040-4039(80)88017-8

Reference yield:

: 15058-64-7
6-α-hydroxypenicillanic acid

: 74772-32-0
6β-iodopenicillanic acid

Guidance literature:: Multi-step reaction with 4 steps

1: N(C₂H₅)3 / dimethylformamide / 17 h / 20 °C

2: 55 percent / N(C₂H₅)3 / CHCl₃ / 0.25 h / 0 °C

3: 100 percent / NaI / acetone / 46 h / Ambient temperature

4: CF₃CO₂H / CH₂Cl₂ / 0.67 h / Ambient temperature

With triethylamine; trifluoroacetic acid; sodium iodide; In dichloromethane; chloroform; N,N-dimethyl-formamide; acetone;
DOI:10.1016/0040-4039(80)88017-8