2-(Cyclohexylidenemethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane - ≥98% , CAS No.74213-49-3

CAS: 74213-49-3 Cat. No.: C590055 Molecular Weight: 222.13 EC Number: 817-617-3
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
EN300-658541 | MFCD31390398 | Z2327672358 | PS-19645 | SY226117 | (Cyclohexylidenemethyl)boronic Acid Pinacol Ester | E88450 | 2-(Cyclohexylidenemethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane | AKOS037621505
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
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Size
Status
Price
Qty
100mg
C590055-100mg
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$117.90

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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice 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

Synonyms
EN300-658541 | MFCD31390398 | Z2327672358 | PS-19645 | SY226117 | (Cyclohexylidenemethyl)boronic Acid Pinacol Ester | E88450 | 2-(Cyclohexylidenemethyl)-4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolane | AKOS037621505
Specifications & Purity
≥98%
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Canonical SmilesB1(OC(C(O1)(C)C)(C)C)C=C2CCCCC2
IUPAC Name2-(cyclohexylidenemethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChIKeyRNSMPCBEIXODBX-UHFFFAOYSA-N
INCHI1S/C13H23BO2/c1-12(2)13(3,4)16-14(15-12)10-11-8-6-5-7-9-11/h10H,5-9H2,1-4H3
Isomeric SMILES B1(OC(C(O1)(C)C)(C)C)C=C2CCCCC2
Molecular Weight 222.13
Reaxy-Rn 9330272
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9330272&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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassBoronic acid derivatives
SubclassBoronic acid esters
Intermediate Tree Nodes Not available
Direct ParentBoronic acid esters
Alternative Parents Dioxaborolanes  Oxacyclic compounds  Organic metalloid salts  Organooxygen compounds  Organoboron compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents 1,3,2-dioxaborolane - Boronic acid ester - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoboron compound - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as boronic acid esters. These are compounds comprising the boronic acid ester functional group RN(X)OR' (R,R'=alkyl, aryl; X= any O, N, Hal residue).
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight222.130 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass222.179 Da
Monoisotopic Mass222.179 Da
Topological Polar Surface Area18.500 Ų
Heavy Atom Count16
Formal Charge0
Complexity270.000
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
Solution Calculators
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