Esculin sesquihydrate - analytical standard, ≥99.9%(HPLC) , CAS No.66778-17-4

CAS: 66778-17-4 Cat. No.: E103662 Fórmula: C15H16O9 · 1.5H2O Peso molecular: 367.31 Número EC: 686-183-3 PubChem CID: 16211025
Disponible para pedir
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. ≥99.9%(HPLC)
Synonyms
7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one;hydrate | MLS002695944 | CHEBI:73111 | AKOS025310104 | Esculetin-6-beta-D-glucopyranoside | CCG-207863 | Esculin Sesquihydrate min. 97.5%, DAB, for biochemistry | M
Storage
Room temperature
Shipped In
Normal
★
Size
Alemania (EU)
USA*
Price
Qty
250mg
E103662-250mg
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8 Disponible

76,27€

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Why this grade

analytical standard, ≥99.9%(HPLC) Patrón analítico for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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 6 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one;hydrate | MLS002695944 | CHEBI:73111 | AKOS025310104 | Esculetin-6-beta-D-glucopyranoside | CCG-207863 | Esculin Sesquihydrate min. 97.5%, DAB, for biochemistry | M
Especificaciones y pureza
analytical standard, ≥99.9%(HPLC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Grado
Patrón analítico
Pureza
≥99.9%(HPLC)
Nombres e identificadores
Pubchem Sid
Sonrisas canónicas
C1=CC(=O)OC2=CC(=C(C=C21)OC3C(C(C(C(O3)CO)O)O)O)O.O
IUPAC Name
7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one;hydrate
InChIKey
CQYPGSKIFJFVDQ-QWFKVUSTSA-N
INCHI
1S/C15H16O9.H2O/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17;/h1-4,10,12-17,19-21H,5H2;1H2/t10-,12-,13+,14-,15-;/m1./s1
Isómeros SMILES
C1=CC(=O)OC2=CC(=C(C=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O.O
CAS alternativo
531-75-9
PubChem CID
16211025
Peso molecular
367.31

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
SuperclassPhenylpropanoids and polyketides
ClaseCoumarins and derivatives
SubclassCoumarin glycosides
Intermediate Tree Nodes Not available
Direct ParentCoumarin glycosides
Alternative Parents Phenolic glycosides  7-hydroxycoumarins  Hexoses  O-glycosyl compounds  1-benzopyrans  Pyranones and derivatives  1-hydroxy-2-unsubstituted benzenoids  Oxanes  Heteroaromatic compounds  Lactones  Secondary alcohols  Oxacyclic compounds  Acetals  Polyols  Primary alcohols  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Coumarin o-glycoside - Coumarin-6-o-glycoside - Phenolic glycoside - 7-hydroxycoumarin - Hydroxycoumarin - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - Benzopyran - 1-benzopyran - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Pyran - Monosaccharide - Oxane - Benzenoid - Heteroaromatic compound - Secondary alcohol - Lactone - Acetal - Oxacycle - Organoheterocyclic compound - Polyol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Primary alcohol - Organooxygen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as coumarin glycosides. These are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety.
External Descriptors hydrate
Estructura 3D
Modelo de Estructura Química Interactiva





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Objetivos asociados (no humanos)
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Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeFechaArticulo
J2514438Certificate of AnalysisSep 28, 2025 E103662
Propiedades químicas y físicas
SensibilidadMoisture sensitive.
Punto de fusión (°C)204-206°C
Peso molecular358.300 g/mol
XLogP3
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Exact Mass358.09 Da
Monoisotopic Mass358.09 Da
Topological Polar Surface Area147.000 Ų
Heavy Atom Count25
Formal Charge0
Complexity495.000
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Citations of This Product
Calculadoras de soluciones
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