Endoxifen

Base Information

• Chemical Name: Endoxifen
• CAS No.: 112093-28-4
• Molecular Formula: C25H27NO2
• Molecular Weight: 373.49
• European Community (EC) Number: 683-027-6,808-709-4
• NSC Number: 749798,746494
• UNII: 46AF8680RC
• DSSTox Substance ID: DTXSID80149880
• Nikkaji Number: J1.507.991F,J393.650C
• Wikipedia: Endoxifen
• Wikidata: Q27149598
• Pharos Ligand ID: 57JTNU3YXJR1
• ChEMBL ID: CHEMBL1093458
• Mol file: 112093-28-4.mol

Synonyms:4-hydroxy-N-demethyltamoxifen;4-hydroxy-N-desmethyltamoxifen;4-hydroxy-N-desmethyltamoxifen, (Z)-isomer;endoxifen;Z-endoxifen

Chemical Property of Endoxifen

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 127-129°C
• Refractive Index: 1.599
• Boiling Point: 519.327 °C at 760 mmHg
• PKA: 10.36±0.15(Predicted)
• Flash Point: 267.88 °C
• PSA: 41.49000
• Density: 1.099 g/cm³
• LogP: 5.75040
• Storage Temp.: Amber Vial, -86°C Freezer, Under Inert Atmosphere
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 373.204179104
• Heavy Atom Count: 28
• Complexity: 467

Purity/Quality:

98%,99%, ^*data from raw suppliers

Endoxifen ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCCNC)C3=CC=CC=C3
• Isomeric SMILES: CC/C(=C(\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)OCCNC)/C3=CC=CC=C3
• Recent ClinicalTrials: Endoxifen in Adults With Hormone Receptor Positive Solid Tumors
• Recent EU Clinical Trials: A Phase 2, Randomized, Double-blinded, Placebo - controlled, Dose Response Study of Oral (Z)-endoxifen in Premenopausal Women with Measurable Breast Density