4-Iodoestradiol

Base Information Edit

Chemical Name:4-Iodoestradiol
CAS No.:61748-87-6
Molecular Formula:C₁₈H₂₃IO₂
Molecular Weight:398.284
Hs Code.:
ChEMBL ID:CHEMBL1627813
DSSTox Substance ID:DTXSID701259796
Nikkaji Number:J2.540.792J
Mol file:61748-87-6.mol

Synonyms:4-iodoestradiol;CHEMBL1627813;DTXSID701259796;61748-87-6;(17beta)-4-Iodoestra-1,3,5(10)-triene-3,17-diol

Suppliers and Price of 4-Iodoestradiol

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
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price

Total 0 raw suppliers

Chemical Property of 4-Iodoestradiol Edit

Chemical Property:

XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:398.07428
Heavy Atom Count:21
Complexity:414

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4I)O
Isomeric SMILES:C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4I)O

Technology Process of 4-Iodoestradiol

There total 2 articles about 4-Iodoestradiol 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: 36.8%

: 50-28-2
estradiol

: 61748-87-6
4-iodo-17β-estradiol

: 24381-12-2
2-Iodoestradiol

Guidance literature:: With mercury(II) diacetate; iodine; In acetic acid; 50 deg C, 10 min; 27 deg C, 60 min;
DOI:10.1080/00021369.1987.10868289