6-fluorobenzo[c][1,2]oxaborol-1(3H)-ol - ≥95% , CAS No.174671-89-7

CAS: 174671-89-7 Cat. No.: F726363 EC Number: 186-382-0 PubChem CID: 11846119
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Storage
Room temperature
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250mg
F726363-250mg
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$30.90

$46.90
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1g
F726363-1g
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$49.90

$74.90
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5g
F726363-5g
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$199.90

$299.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships 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

Specifications & Purity
≥95%
Storage
Room temperature
Purity
≥95%
Names and Identifiers
Canonical SmilesB1(C2=C(CO1)C=CC(=C2)F)O
IUPAC Name6-fluoro-1-hydroxy-3H-2,1-benzoxaborole
InChIKeyQNCOVKFUYLBCNG-UHFFFAOYSA-N
INCHI1S/C7H6BFO2/c9-6-2-1-5-4-11-8(10)7(5)3-6/h1-3,10H,4H2
Isomeric SMILES B1(C2=C(CO1)C=CC(=C2)F)O
PubChem CID 11846119

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
SuperclassOrganohalogen compounds
ClassAryl halides
SubclassAryl fluorides
Intermediate Tree Nodes Not available
Direct ParentAryl fluorides
Alternative Parents Benzenoids  Oxaborole derivatives  Boronic acid esters  Oxacyclic compounds  Organic metalloid salts  Organooxygen compounds  Organometalloid compounds  Organofluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzenoid - Aryl fluoride - 1,2-oxaborole derivative - Boronic acid ester - Boronic acid derivative - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organic metalloid moeity - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aryl fluorides. These are organic compounds containing the acyl fluoride functional group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Trichophyton benhamiae (1686 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aspergillus fumigatus (16427 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Cryptococcus neoformans (21258 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight151.930 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass152.044 Da
Monoisotopic Mass152.044 Da
Topological Polar Surface Area29.500 Ų
Heavy Atom Count11
Formal Charge0
Complexity155.000
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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