2-Methylphenylboronic acid, propanediol cyclic ester - ≥95% , CAS No.163517-56-4

CAS: 163517-56-4 Cat. No.: M181908 Fórmula: C10H13BO2 Peso molecular: 176 Número CE: 690-466-7
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
BS-21642 | 1,3,2-Dioxaborinane, 2-(2-methylphenyl)- | AKOS004113826 | 2-Methylbenzeneboronic acid 1,3-propanediol ester | UIDYFYHQHHMEKA-UHFFFAOYSA-N | 2-(2-methylphenyl)-1,3,2-dioxaborinane | SCHEMBL7591871 | 2-(o-Tolyl)-1,3,2-dioxaborinane | 2-Methylben
Storage
Room temperature
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
1g
M181908-1g
Sob encomenda · 8–12 semanas
22,47€
5g
M181908-5g
Sob encomenda · 8–12 semanas
79,75€
25g
M181908-25g
Sob encomenda · 8–12 semanas
359,16€
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
BS-21642 | 1,3,2-Dioxaborinane, 2-(2-methylphenyl)- | AKOS004113826 | 2-Methylbenzeneboronic acid 1,3-propanediol ester | UIDYFYHQHHMEKA-UHFFFAOYSA-N | 2-(2-methylphenyl)-1,3,2-dioxaborinane | SCHEMBL7591871 | 2-(o-Tolyl)-1,3,2-dioxaborinane | 2-Methylben
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Pureza
≥95%
Nomes e identificadores
Sorrisos canónicosB1(OCCCO1)C2=CC=CC=C2C
IUPAC Name2-(2-methylphenyl)-1,3,2-dioxaborinane
InChIKeyUIDYFYHQHHMEKA-UHFFFAOYSA-N
INCHI1S/C10H13BO2/c1-9-5-2-3-6-10(9)11-12-7-4-8-13-11/h2-3,5-6H,4,7-8H2,1H3
SMILES isoméricas B1(OCCCO1)C2=CC=CC=C2C
Peso molecular 176
Reaxy-Rn 9324333
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9324333&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
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassToluenes
Intermediate Tree Nodes Not available
Direct ParentToluenes
Alternative Parents Boronic acid esters  Oxacyclic compounds  Organic metalloid salts  Organooxygen compounds  Organometalloid compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Toluene - Boronic acid ester - Boronic acid derivative - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic metalloid moeity - Aromatic heteromonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Peso molecular176.020 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass176.101 Da
Monoisotopic Mass176.101 Da
Topological Polar Surface Area18.500 Ų
Heavy Atom Count13
Formal Charge0
Complexity157.000
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
Calculadoras de soluções
Revisões

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