3-Hydroxy Carbofuran - Analytical standard, Moligand™, ≥98% , CAS No.16655-82-6

CAS: 16655-82-6 Cat. No.: H132504 Formule: C12H15NO4 Poids moléculaire: 237.25 Beilstein Registry Number: 1383873 Numéro CE: 625-078-9
DISPONIBLE À COMMANDE
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
Synonyms
UNII-7J7N7A61BJ | 3-Hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate | CHEBI:174216 | 2,3-Dihydro-2,2-dimethyl-3,7-benzofurandiol 7-(methylcarbamate) | DTXSID2037506 | SCHEMBL3400466 | 3-(2-OXO-PROPYL)-BENZOICACIDETHYLESTER | CCRIS 9207
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
Allemagne (EU)
USA*
Price
Qty
5mg
H132504-5mg
Sur commande · 8–12 semaines
138,75€
10mg
H132504-10mg
Sur commande · 8–12 semaines

353,08€

412,09€
Enregistrer 59,01 € (14.32%)
25mg
H132504-25mg
Sur commande · 8–12 semaines
416,43€
100mg
H132504-100mg
Sur commande · 8–12 semaines
997,81€
Enter a quantity for the sizes you want to add.
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Why this grade

Analytical standard, Moligand™, ≥98% Étalon d'analyse,Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Vue d’ensemble

3-Hydroxycarbofuran, a major metabolite of Carbofuran, is a reversible acetylcholinesterase (AChE) inhibitor.

Specifications

Synonymes
UNII-7J7N7A61BJ | 3-Hydroxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl methylcarbamate | CHEBI:174216 | 2,3-Dihydro-2,2-dimethyl-3,7-benzofurandiol 7-(methylcarbamate) | DTXSID2037506 | SCHEMBL3400466 | 3-(2-OXO-PROPYL)-BENZOICACIDETHYLESTER | CCRIS 9207
Spécifications et pureté
Analytical standard, Moligand™, ≥98%
Conditions de stockage de stockage
Store at -20°C
Expédié en
Ice chest + Ice pads
Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.
Grade
Étalon d'analyse, Moligand™
Type d'action
INHIBITOR
Pureté
≥98%
Noms et identifiants
Sourires canoniques
CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C
IUPAC Name
(3-hydroxy-2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate
InChIKey
RHSUJRQZTQNSLL-UHFFFAOYSA-N
INCHI
1S/C12H15NO4/c1-12(2)10(14)7-5-4-6-8(9(7)17-12)16-11(15)13-3/h4-6,10,14H,1-3H3,(H,13,15)
Isomères SMILES
CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C
WGK Allemagne
3
RTECS
FB9500000
Poids moléculaire
237.25
Beilstein
1383873
Reaxy-Rn
1383873
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1383873&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
SuperclassOrganoheterocyclic compounds
ClasseCoumarans
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentCoumarans
Alternative Parents Alkyl aryl ethers  Benzenoids  Carbamate esters  Secondary alcohols  Organic carbonic acids and derivatives  Oxacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Coumaran - Alkyl aryl ether - Benzenoid - Carbamic acid ester - Secondary alcohol - Carbonic acid derivative - Oxacycle - Ether - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors Not available
Structure 3D
Modèle de structure chimique interactif





Cibles associées (humaines)
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Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mécanismes d'action
Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriétés chimiques et physiques
Poids moléculaire237.250 g/mol
XLogP31.200
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass237.1 Da
Monoisotopic Mass237.1 Da
Topological Polar Surface Area67.800 Ų
Heavy Atom Count17
Formal Charge0
Complexity305.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
FAQ et articles
Citations of This Product
Calculateurs de solution
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