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Home/Compounds/CAS 533-31-3
Formula C7H6O3MW 138.12Research-use catalog entryCOA/SDS by request

Sesamol

CAS Number: 533-31-3

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Loading RDKit molecule structure...
InChIKey: LUSZGTFNYDARNI-UHFFFAOYSA-NC7H6O3 | MW 138.12

Chemical Absolute Identifiers

CAS Number

533-31-3

PubChem CID

68289

Molecular Formula

C7H6O3

Molecular Weight

138.12 g/mol

Exact Mass

138.031694

InChIKey

LUSZGTFNYDARNI-UHFFFAOYSA-N

IUPAC Name

1,3-benzodioxol-5-ol

SMILES String

C1OC2=C(O1)C=C(C=C2)O

Physical Properties

Melting Point

64.9–65.8 °C

Boiling Point

272–274 °C

pKa

9.79

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

Catalog Facts

Structural features

Sesamol (CAS 533-31-3) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C7H6O3 and molecular weight 138. 12 g/mol.

Sourcing context

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

Research use context

Intended for research-stage medicinal chemistry and intermediate synthesis workflows.

Documentation needs

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

Applications & Classification

Pharmaceutical Intermediate ResearchResearch intermediateCustom synthesis building blockPharmaceutical intermediate researchResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Cytochrome P450 3A4 (Homo sapiens) — 2 assays; Androgen receptor (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Cytochrome P450 3A4

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 4.8

Experimental evidence source: ChEMBL

Androgen receptor

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

  • Keep container tightly closed and dry.
  • Store in a well-ventilated place.

PPE

Respiratory protection if needed

First Aid

  • Do not give anything to an unconscious person.
  • Rinse mouth with water.

Stability / Reactivity

  • Reactivity.
  • Carbon monoxide, carbon dioxide.

Disposal

  • Waste product.
  • Dispose of remaining and non-recyclable solutions to a licensed company.
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Fire Fighting

  • If necessary, wear a self-contained breathing apparatus for firefighting.

Accidental Release

  • Do not generate dust when collecting and disposing.
  • Use personal protective equipment and emergency procedures.

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

Preliminary Safety Reference

For supplier-issued SDS or COA, submit a documentation request.

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Sesamol

Names & Synonyms

3,4-Methylenedioxyphenol5-Hydroxy-1,3-benzodioxole2H-1,3-Benzodioxol-5-OlMethylene ether of oxyhydroquinonePhenol, 3,4-(methylenedioxy)-
Show all synonyms
3,4-(Methylenedioxy)phenol3,4-Methylendioxyphenolbenzo[d][1,3]dioxol-5-ol5-Benzodioxolol2H-benzo[d]1,3-dioxolen-5-olsesamol lithiumsesamol sodium1,3-Benzodioxol-5-ol (Sesamol)CCRIS 1386sesamol, ion (1+)sesamol titanium (+4)BZX1,2,4-Benzenetriol methylene ether
External Identifiers
EC NUMBER: 208-561-5DSSTOX SUBSTANCE ID: DTXSID9021267CHEMBL ID: CHEMBL1517998CHEBI ID: CHEBI:9126UNII: 94IEA0NV89HMDB ID: HMDB0033812KEGG ID: C10832METABOLOMICS WORKBENCH ID: 46218WIKIDATA ID: Q418080benzodioxol-5-ol
Experimental Spectrum References
13C NMR Spectra1D NMR Spectra1H NMR SpectraATR-IR Spectra — Forensic Spectral ResearchFTIR SpectraRaman Spectra — Forensic Spectral ResearchUV-VIS Spectra
Literature & Patent References
DOI 10.1016/j.ejmech.2022.114954Structure activity relationship (SAR) and anticancer activity of pyrrolidine derivatives: Recent developments and future prospects (A review).DOI 10.1016/j.ejmech.2023.115655Recent advances in triazoles as tyrosinase inhibitors.PMID 36481599Structure activity relationship (SAR) and anticancer activity of pyrrolidine derivatives: Recent developments and future prospects (A review).PMID 37482020Recent advances in triazoles as tyrosinase inhibitors.DOI 10.1016/j.bmcl.2020.127716Preparations and antioxidant activities of sesamol and it's derivatives.PMID 33249134Preparations and antioxidant activities of sesamol and it's derivatives.DOI 10.1016/j.ejmech.2020.112480Kojic acid-natural product conjugates as mushroom tyrosinase inhibitors.PMID 32652434Kojic acid-natural product conjugates as mushroom tyrosinase inhibitors.

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

1,3-Benzodioxole, 5-(methoxymethoxy)-CAS 111726-43-3
1,3-Benzodioxol-4-ol, 5-(methoxymethoxy)-CAS 244126-41-8

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 111726-43-31,3-Benzodioxole, 5-(methoxymethoxy)-CAS 101-18-83-Hydroxy-N-phenylanilineCAS 112574-44-4NitrofurazoneCAS 118-75-2ChloranilCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acidCAS 1018144-00-72-(3-Cyclopropyl-6-isopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

RFQ questions for CAS 533-31-3

What are the key identifiers for Sesamol (CAS 533-31-3)?

Sesamol is identified by CAS 533-31-3, with molecular formula C7H6O3, molecular weight 138.12, InChIKey LUSZGTFNYDARNI-UHFFFAOYSA-N.

Does CAS 533-31-3 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Cytochrome P450 3A4, Androgen receptor. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 533-31-3?

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

Can I request supplier SDS for Sesamol?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 533-31-3 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

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