1-[2-(oxan-2-yloxy)ethyl]-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole - ≥97% , CAS No.956907-34-9

CAS: 956907-34-9 Cat. No.: O178540 Peso molecular: 322.21
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
(1H-indol-3-yl)-acetic acid methyl ester | 1-[2-(oxan-2-yloxy)ethyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole | MFCD16294418 | SCHEMBL253078 | 1-[2-[(Tetrahydro-2H-pyran-2-yl)oxy]ethyl]pyrazole-4-boronic Acid Pinacol Ester | 1-(2-(tetrahydr
Storage
Temperatura ambiente
Shipped In
Normal
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Size
Estado
Price
Qty
500mg
O178540-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

3.001,90US$

3.503,90US$
Guardar 502,00 US$ (14.33%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Temperatura ambiente Ships Normal 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

Sinónimos
(1H-indol-3-yl)-acetic acid methyl ester | 1-[2-(oxan-2-yloxy)ethyl]-4-(4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolan-2-yl)pyrazole | MFCD16294418 | SCHEMBL253078 | 1-[2-[(Tetrahydro-2H-pyran-2-yl)oxy]ethyl]pyrazole-4-boronic Acid Pinacol Ester | 1-(2-(tetrahydr
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Temperatura ambiente
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasB1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CCOC3CCCCO3
IUPAC Name1-[2-(oxan-2-yloxy)ethyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
InChIKeyYWRBLSYOLXMZGA-UHFFFAOYSA-N
INCHI1S/C16H27BN2O4/c1-15(2)16(3,4)23-17(22-15)13-11-18-19(12-13)8-10-21-14-7-5-6-9-20-14/h11-12,14H,5-10H2,1-4H3
Isómeros SMILES B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CCOC3CCCCO3
Peso molecular 322.21
Reaxy-Rn 15584822
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15584822&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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseOxanes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentOxanes
Alternative Parents Pyrazoles  Heteroaromatic compounds  Dioxaborolanes  Boronic acid esters  Oxacyclic compounds  Organic metalloid salts  Azacyclic compounds  Acetals  Organopnictogen compounds  Organonitrogen compounds  Organometalloid compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Oxane - Azole - Boronic acid ester - 1,3,2-dioxaborolane - Pyrazole - Heteroaromatic compound - Boronic acid derivative - Azacycle - Organic metalloid salt - Acetal - Oxacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular322.200 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass322.206 Da
Monoisotopic Mass322.206 Da
Topological Polar Surface Area54.700 Ų
Heavy Atom Count23
Formal Charge0
Complexity392.000
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
Calculadoras de soluciones
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