Home Other Building Blocks 68047-06-3
68047-06-3,MFCD00468090
Catalog No.:AA00FBDP

68047-06-3 | 4-Hydroxytamoxifen

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1mg
≥98%
in stock  
$53.00   $37.00
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5mg
in stock  
$183.00   $128.00
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10mg
in stock  
$218.00   $153.00
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25mg
in stock  
$415.00   $290.00
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100mg
97%
in stock  
$966.00   $677.00
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250mg
97%
in stock  
$1,424.00   $997.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00FBDP
Chemical Name:
4-Hydroxytamoxifen
CAS Number:
68047-06-3
Molecular Formula:
C26H29NO2
Molecular Weight:
387.5140
MDL Number:
MFCD00468090
SMILES:
CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3
Properties
Computed Properties
 
Complexity:
493  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
8  
XLogP3:
6.8  

Downstream Synthesis Route

[1]Foster;Jarman;Leung;McCague;Leclercq;Devleeschouwer[JournalofMedicinalChemistry,1985,vol.28,#10,p.1491-1497]

4-<2-(dimethylamino)ethoxy>phenylzincchloride 
  126402-33-3    68047-06-3 

[1]Al-Hassan,MohammedI.[SyntheticCommunications,1989,vol.19,#9-10,p.1619-1624]

[1]McCague,Raymond[JournalofChemicalResearch,Miniprint,1986,#2,p.771-793]

[1]Olier-Reuchet,Chantal;Aitken,DavidJ.;Bucourt,Robert;Husson,Henri-Philippe[TetrahedronLetters,1995,vol.36,#45,p.8221-8224]

[1]JournalofOrganicChemistry,1996,vol.61,p.3890-3893

[2]JournalofOrganicChemistry,1996,vol.61,p.3890-3893

Literature

Title: Jordan VC, et al. A monohydroxylated metabolite of tamoxifen with potent antioestrogenic activity. J Endocrinol. 1977 Nov;75(2):305-16.

Title: Davis KM, et al. Small molecule-triggered Cas9 protein with improved genome-editing specificity. Nat Chem Biol. 2015 May;11(5):316-8.

Title: Kuo YM, et al. 4-Hydroxytamoxifen attenuates methamphetamine-induced nigrostriatal dopaminergic toxicity in intact and gonadetomized mice. J Neurochem. 2003 Dec;87(6):1436-43.

Title: Zhang J, et al. Drug Inducible CRISPR/Cas Systems. Comput Struct Biotechnol J. 2019;17:1171-1177.

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SDS
Tags:68047-06-3 Molecular Formula|68047-06-3 MDL|68047-06-3 SMILES|68047-06-3 4-Hydroxytamoxifen