Ro67-4853 - Moligand™ , Allosteric modulator of mGlu 1 receptor, CAS No.R613259, Allosteric modulator of mGlu 1 receptor

CAS: R613259 Cat. No.: R613259 PubChem CID: 9949202
Disponibile su ordine
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.
Synonyms
Carbamic acid, (9H-xanthen-9-ylcarbonyl)-, butyl ester | RQBUXEUMZZQUFY-UHFFFAOYSA-N | butyl 9H-xanthene-9-carbonylcarbamate | NCGC00370922-01 | QM27L9Q3RZ | SCHEMBL3727778 | AKOS024458108 | Butyl N-(9H-xanthen-9-ylcarbonyl)carbamate | FT-0674449 | (9H-xa
Storage
Room temperature
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Size
Germania (EU)
USA*
Price
Qty
5mg
R613259-5mg
Su ordinazione · 8–12 settimane

991,74€

1.158,34€
Salva 166,61 € (14.38%)
25mg
R613259-25mg
Su ordinazione · 8–12 settimane
1.389,16€
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships 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

Sinonimi
Carbamic acid, (9H-xanthen-9-ylcarbonyl)-, butyl ester | RQBUXEUMZZQUFY-UHFFFAOYSA-N | butyl 9H-xanthene-9-carbonylcarbamate | NCGC00370922-01 | QM27L9Q3RZ | SCHEMBL3727778 | AKOS024458108 | Butyl N-(9H-xanthen-9-ylcarbonyl)carbamate | FT-0674449 | (9H-xa
Specifiche e purezza
Moligand™
Condizioni di conservazione di stoccaggio
Room temperature
Grado
Moligand™
Tipo di azione
ALLOSTERIC MODULATOR
Meccanismo d'azione
Allosteric modulator of mGlu 1 receptor
Nomi e identificatori
Sorrisi canoniciCCCCOC(=O)NC(=O)C1c2ccccc2Oc2c1cccc2
IUPAC Namebutyl N-(9H-xanthene-9-carbonyl)carbamate
InChIKeyRQBUXEUMZZQUFY-UHFFFAOYSA-N
INCHI1S/C19H19NO4/c1-2-3-12-23-19(22)20-18(21)17-13-8-4-6-10-15(13)24-16-11-7-5-9-14(16)17/h4-11,17H,2-3,12H2,1H3,(H,20,21,22)
Isomeri SMILES CCCCOC(=O)NC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13
PubChem CID 9949202

Documentazione

📋 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
SuperclassOrganoheterocyclic compounds
ClasseBenzopyrans
Subclass1-benzopyrans
Intermediate Tree Nodes Dibenzopyrans
Direct ParentXanthenes
Alternative Parents Diarylethers  Benzenoids  Dicarboximides  Carbamate esters  Oxacyclic compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Xanthene - Diaryl ether - Benzenoid - Dicarboximide - Carbamic acid ester - Ether - Carboxylic acid derivative - Oxacycle - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Obiettivi associati (umani)
GRM1 Tchem Metabotropic glutamate receptor 1 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Proprietà chimiche e fisiche
Peso molecolare325.400 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass325.131 Da
Monoisotopic Mass325.131 Da
Topological Polar Surface Area64.599 Ų
Heavy Atom Count24
Formal Charge0
Complexity431.000
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
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

Domande frequenti

How should this product be stored?
Store at room temperature.
What is Moligand??
Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is R613259. InChIKey RQBUXEUMZZQUFY-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

Need help choosing the grade?

Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.

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