Fluorobexarotene - Moligand™, ≥97%(HPLC) , Agonist of Retinoid X receptor-α, CAS No.1190848-23-7, Agonist of Retinoid X receptor-α

CAS: 1190848-23-7 Cat. No.: F288070 Molecular Weight: 366.47
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GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%(HPLC)
Synonyms
GTPL8904 | 2-fluoro-4-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)vinyl)benzoic acid | AKOS024457960 | NSC783327 | NSC-783327 | Q27077689 | HY-108525 | F9994-0680 | DTXSID001021433 | 2-fluoro-4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthal
Storage
Store at 2-8°C
Shipped In
Wet ice
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Size
Status
Price
Qty
10mg
F288070-10mg
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Why this grade

Moligand™, ≥97%(HPLC) Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
GTPL8904 | 2-fluoro-4-(1-(3, 5, 5, 8, 8-pentamethyl-5, 6, 7, 8-tetrahydronaphthalen-2-yl)vinyl)benzoic acid | AKOS024457960 | NSC783327 | NSC-783327 | Q27077689 | HY-108525 | F9994-0680 | DTXSID001021433 | 2-fluoro-4-[1-(3, 5, 5, 8, 8-pentamethyl-6, 7-dihydronaphthal
Specifications & Purity
Moligand™, ≥97%(HPLC)
Biochemical and Physiological Mechanisms
RXR agonist (Ki= 12 nM; EC50= 43 nM at RXRαreceptors). Displays similar RAR agonist activity to bexarotene; exhibits an apparent RXR binding affinity 75% greater than bexarotene.
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Grade
Moligand™
Action Type
AGONIST
Mechanism of action
Agonist of Retinoid X receptor-α
Purity
≥97%(HPLC)
Names and Identifiers
Canonical SmilesCC1=CC2=C(C=C1C(=C)C3=CC(=C(C=C3)C(=O)O)F)C(CCC2(C)C)(C)C
IUPAC Name2-fluoro-4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid
InChIKeyLWKAWHRSPCHMPJ-UHFFFAOYSA-N
INCHI1S/C24H27FO2/c1-14-11-19-20(24(5,6)10-9-23(19,3)4)13-18(14)15(2)16-7-8-17(22(26)27)21(25)12-16/h7-8,11-13H,2,9-10H2,1,3-6H3,(H,26,27)
Isomeric SMILES CC1=CC2=C(C=C1C(=C)C3=CC(=C(C=C3)C(=O)O)F)C(CCC2(C)C)(C)C
Molecular Weight 366.47
Reaxy-Rn 19889910
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19889910&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
ClassPrenol lipids
SubclassRetinoids
Intermediate Tree Nodes Not available
Direct ParentRetinoids
Alternative Parents Sesquiterpenoids  Tetralins  Halobenzoic acids  2-halobenzoic acids  Benzoic acids  Styrenes  Benzoyl derivatives  1-carboxy-2-haloaromatic compounds  Fluorobenzenes  Aryl fluorides  Vinylogous halides  Organooxygen compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Bexarotene - Sesquiterpenoid - Bisabolane sesquiterpenoid - Tetralin - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzoic acid - 1-carboxy-2-haloaromatic compound - Styrene - Benzoyl - Fluorobenzene - Halobenzene - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Vinylogous halide - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic homopolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as retinoids. These are oxygenated derivatives of 3,7-dimethyl-1-(2,6,6-trimethylcyclohex-1-enyl)nona-1,3,5,7-tetraene and derivatives thereof.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
RXRA Tclin Retinoic acid receptor RXR-alpha (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Associated Targets(non-human)
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySolvent:DMSO, Max Conc. mg/mL: 36.65, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 9.16, Max Conc. mM: 25
Molecular Weight366.500 g/mol
XLogP37.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass366.2 Da
Monoisotopic Mass366.2 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count27
Formal Charge0
Complexity593.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

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