Toremifene citrate

Base Information

• Chemical Name: Toremifene citrate
• CAS No.: 89778-27-8
• Molecular Formula: C₆H₈O₇*C₂₆H₂₈ClNO
• Molecular Weight: 598.093
• Hs Code.: 2942000000
• European Community (EC) Number: 663-344-6
• NSC Number: 759190,613680
• UNII: 2498Y783QT
• DSSTox Substance ID: DTXSID2021367
• Wikidata: Q27253831
• NCI Thesaurus Code: C1756
• RXCUI: 49953
• ChEMBL ID: CHEMBL1200675
• Mol file: 89778-27-8.mol

Synonyms:Citrate, Toremifene;Fareston;FC 1157a;FC-1157a;FC1157a;Toremifene;Toremifene Citrate;Toremifene Citrate (1:1);Toremifene, (E)-Isomer

Chemical Property of Toremifene citrate

Chemical Property:

• Appearance/Colour: White or almost white powder
• Melting Point: 158-164oC
• Refractive Index: 1,416-1,418
• Boiling Point: 535.1 °C at 760 mmHg
• Flash Point: 277.4 °C
• PSA: 144.60000
• Density: 1.045 g/cm³
• LogP: 4.96650
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO: >10mg/mL
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 14
• Exact Mass: 597.2129448
• Heavy Atom Count: 42
• Complexity: 710

Purity/Quality:

Toremifene citrate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,N,Xn
• Statements: 36/37/38-50/53-41-22
• Safety Statements: 26-37/39-61-60-39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN(C)CCOC1=CC=C(C=C1)C(=C(CCCl)C2=CC=CC=C2)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
• Isomeric SMILES: CN(C)CCOC1=CC=C(C=C1)/C(=C(/CCCl)\C2=CC=CC=C2)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
• Recent ClinicalTrials: Breast Cancer Treatment Based on Organ-like Culture
• Recent EU Clinical Trials: Molecular-biological tumor profiling for drug treatment selection in patients with advanced and refractory carcinoma
• Description: Toremifene (citrate) is an orally bioavailable selective estrogen receptor modulator (SERM) that evokes tissue-dependent effects similar to that of tamoxifen . It has been shown to block estrogen-stimulated growth of MCF-7 breast cancer cells grown in tissue culture, to inhibit ovariectomy-induced bone loss in rats, and to stimulate endometrial growth similar to that of tamoxifen.
• Uses: An antiestrogen and antineoplastic. Nonsteroidal antiestrogen structurally similar to Tamoxifen. Toremifene citrate salt has been used:in cell-based ELISAas a positive control to detect its antiviral activity against Ebola virus (EBOV)to treat MCF7 and T47D breast cancer cell lines

Technology Process of Toremifene citrate

There total 1 articles about Toremifene citrate 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:

citric acid (77-92-9,906507-37-7) + toremifene (89778-26-7) → toremifene citrate (89778-27-8)

Guidance literature:

In acetone; at 20 - 25 ℃; Product distribution / selectivity;

upstream raw materials:

citric acid

toremifene

Refernces