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Home/Compounds/CAS 117098-94-9
Formula C7H8BNO2MW 148.96Research-use catalog entryCOA/SDS by request

6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol

CAS Number: 117098-94-9

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Loading RDKit molecule structure...
InChIKey: USCKQKQTFCBECF-UHFFFAOYSA-NC7H8BNO2 | MW 148.96

Chemical Absolute Identifiers

CAS Number

117098-94-9

PubChem CID

3770187

Molecular Formula

C7H8BNO2

Molecular Weight

148.96 g/mol

Exact Mass

149.064809

InChIKey

USCKQKQTFCBECF-UHFFFAOYSA-N

IUPAC Name

1-hydroxy-3H-2,1-benzoxaborol-6-amine

SMILES String

Nc1ccc2c(c1)B(O)OC2

Physical Properties

No physical property values available.

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol (CAS 117098-94-9) is listed in the Advanced Chemicals portfolio, with molecular formula C7H8BNO2 and molecular weight 148. 96 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle, boronic-acid-related structure.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Boronic Acids and EstersSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Carbonic anhydrase 2 (Homo sapiens) — 3 assays; Carbonic anhydrase 1 (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Carbonic anhydrase 2

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 3 documents · best pChEMBL 6.23

Experimental evidence source: ChEMBL

Carbonic anhydrase 1

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 2 documents · best pChEMBL 5.03

Experimental evidence source: ChEMBL

Safety & Handling

Safety and handling reference content is available through documentation requests.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

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Names & Synonyms / External Identifiers

Chemical Name

6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol

Names & Synonyms

6-Aminobenzo[c][1,2]oxaborol-1(3H)-ol2,1-Benzoxaborol-6-amine, 1,3-dihydro-1-hydroxy-6-amino-1,3-dihydro-2,1-benzoxaborol-1-ol6-Amino-3H-2,1-benzoxaborol-1-ol5-Aminoboronphthalide
Show all synonyms
1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-6-amine6-Amino-1-hydroxy-2,1-benzoxaborolane5-Amino-2-(hydroxymethyl)phenylboronic Acid Cyclic Monoester6-Amino-2,1-benzoxaborol-1(3H)-ol6-amino-3H-benzo[c][1,2]oxaborol-1-ol6-aminobenzo[c][1,2]oxaborol-1 (3h)-olA25596-Amino-1,3-dihydro-1-hydroxy-2,1-benzoxaborole6-Aminobenzo[c][1,2]oxaborol-1(3H)-ol, 117098-94-9, AC1MXRDC, SureCN597113, CTK8C2622, ANW-68695, AKOS016005929, 1-hydroxy-3H-2,1-benzoxaborol-6-amine, AK-72711, KB-247570
External Identifiers
EC NUMBER: 810-937-4DSSTOX SUBSTANCE ID: DTXSID20396179CHEMBL ID: CHEMBL4167266WIKIDATA ID: Q82196749
Literature & Patent References
DOI 10.1021/acs.jmedchem.4c01516Benzoxaborinine, New Chemotype for Carbonic Anhydrase Inhibition: <i>Ex Novo</i> Synthesis, Crystallography, <i>In Silico</i> Studies, and Anti-Melanoma Cell Line Activity.PMID 39378331Benzoxaborinine, New Chemotype for Carbonic Anhydrase Inhibition: <i>Ex Novo</i> Synthesis, Crystallography, <i>In Silico</i> Studies, and Anti-Melanoma Cell Line Activity.DOI 10.1016/j.ejmech.2022.114585Discovery of potent benzoxaborole inhibitors against SARS-CoV-2 main and dengue virus proteases.PMID 35863275Discovery of potent benzoxaborole inhibitors against SARS-CoV-2 main and dengue virus proteases.DOI 10.1021/acsmedchemlett.0c00403Benzoxaboroles: New Potent Inhibitors of the Carbonic Anhydrases of the Pathogenic Bacterium Vibrio cholerae.PMID 33214840Benzoxaboroles: New Potent Inhibitors of the Carbonic Anhydrases of the Pathogenic Bacterium Vibrio cholerae.DOI 10.1021/acsmedchemlett.7b00369Benzoxaboroles as Efficient Inhibitors of the β-Carbonic Anhydrases from Pathogenic Fungi: Activity and Modeling Study.PMID 29152053Benzoxaboroles as Efficient Inhibitors of the β-Carbonic Anhydrases from Pathogenic Fungi: Activity and Modeling Study.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

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Non-public related references

5-Amino-2,1-benzoxaborol-1(3H)-olCAS 947165-26-6
7-amino-3,4-dihydro-1H-2,1-benzoxaborinin-1-olCAS 1335095-08-3
1,3-Dihydro-2,1-benzoxaborole-1,6-diolCAS 1196473-37-6
6-Fluorobenzo[c][1,2]oxaborol-1(3H)-olCAS 174671-89-7
6-Methyl-1,3-dihydro-2,1-benzoxaborol-1-olCAS 92333-30-7

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 947165-26-65-Amino-2,1-benzoxaborol-1(3H)-olCAS 1335095-08-37-amino-3,4-dihydro-1H-2,1-benzoxaborinin-1-olCAS 1196473-37-61,3-Dihydro-2,1-benzoxaborole-1,6-diolCAS 174671-89-76-Fluorobenzo[c][1,2]oxaborol-1(3H)-olCAS 92333-30-76-Methyl-1,3-dihydro-2,1-benzoxaborol-1-olCAS 118803-40-02-(Hydroxymethyl)-5-nitrobenzeneboronic acid dehydrateCAS 133-67-5TrichlormethiazideCAS 138-41-0CarzenideCAS 5735-41-11-Hydroxy-2,1-benzoxaboroleCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamate

RFQ questions for CAS 117098-94-9

What are the key identifiers for 6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol (CAS 117098-94-9)?

6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol is identified by CAS 117098-94-9, with molecular formula C7H8BNO2, molecular weight 148.96, InChIKey USCKQKQTFCBECF-UHFFFAOYSA-N.

Does CAS 117098-94-9 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Carbonic anhydrase 2, Carbonic anhydrase 1. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 117098-94-9?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for 6-Aminobenzo(c)(1,2)oxaborol-1(3H)-ol?

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