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Tamoxifen Citrate
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$43.99$59.99
- Concentration
- 20 mg per mL
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$43.99$59.99
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| Molecular Formula | C32H37NO8 |
| Molecular Weight | 563.6 |
| Monoisotopic Mass | 563.25191714 |
| Polar Area | 145 |
| Complexity | 690 |
| Heavy Atom Count | 41 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 13 |
| Physical Appearance | White Opaque Liquid |
| Stability | Room Temperature |
| PubChem LCSS | Tamoxifen Citrate Laboratory Chemical Safety Summary |
| Property | Property Value |
|---|---|
| CID | 2733525 |
| CAS | 54965-24-1 |
| InChI | InChI=1S/C26H29NO.C6H8O7/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3;7-3(8)1-6(13, 5(11)12)2-4(9)10/h5-18H, 4, 19-20H2, 1-3H3;13H, 1-2H2, (H, 7, 8)(H, 9, 10)(H, 11, 12)/b26-25-; |
| InChIKey | FQZYTYWMLGAPFJ-OQKDUQJOSA-N |
| Isomeric SMILES | CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| Canonical SMILES | CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| IUPAC Name | 2-[4-[(Z)-1, 2-diphenylbut-1-enyl]phenoxy]-N, N-dimethylethanamine;2-hydroxypropane-1, 2, 3-tricarboxylic acid |
Generated by Extreme Peptide with Open Babel, version 2.3.1, http://openbabel.org (accessed June 28, 2022)
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