3,6-Dihydro-2H-thiopyran-4-ylboronic acid pinacol ester - ≥97% , CAS No.862129-81-5

CAS: 862129-81-5 Cat. No.: D177705 Molecular Weight: 226.14 EC Number: 691-334-1
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
MFCD10700154 | SCHEMBL252498 | 2-(3,6-Dihydro-2H-thiopyran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane | 2H-Thiopyran, 3,6-dihydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- | AKOS016842561 | FT-0648982 | potassium?trifluoro(methoxymethyl)borate |
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
D177705-250mg
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$9.90
1g
D177705-1g
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$19.90

$21.90
Save $2.00 (9.13%)
5g
D177705-5g
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$72.90

$80.90
Save $8.00 (9.89%)
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Why this grade

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

🌡

Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads 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.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
MFCD10700154 | SCHEMBL252498 | 2-(3, 6-Dihydro-2H-thiopyran-4-yl)-4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolane | 2H-Thiopyran, 3, 6-dihydro-4-(4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolan-2-yl)- | AKOS016842561 | FT-0648982 | potassium?trifluoro(methoxymethyl)borate |
Specifications & Purity
≥97%
Storage
Store at -20°C, Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%
Names and Identifiers
Canonical SmilesB1(OC(C(O1)(C)C)(C)C)C2=CCSCC2
IUPAC Name2-(3,6-dihydro-2H-thiopyran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChIKeyQZVRTORVCKGPPY-UHFFFAOYSA-N
INCHI1S/C11H19BO2S/c1-10(2)11(3,4)14-12(13-10)9-5-7-15-8-6-9/h5H,6-8H2,1-4H3
Isomeric SMILES B1(OC(C(O1)(C)C)(C)C)C2=CCSCC2
Molecular Weight 226.14
Reaxy-Rn 11090000
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11090000&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
ClassThiopyrans
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThiopyrans
Alternative Parents Dioxaborolanes  Boronic acid esters  Oxacyclic compounds  Organic metalloid salts  Dialkylthioethers  Organooxygen compounds  Organometalloid compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Thiopyran - 1,3,2-dioxaborolane - Boronic acid ester - Boronic acid derivative - Oxacycle - Organic metalloid salt - Dialkylthioether - Thioether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic metalloid moeity - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thiopyrans. These are compounds containing a six-member aliphatic heterocycle made up of one sulfur atom and five carbon atoms.
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 Weight226.150 g/mol
XLogP3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass226.12 Da
Monoisotopic Mass226.12 Da
Topological Polar Surface Area43.800 Ų
Heavy Atom Count15
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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