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Home/Compounds/CAS 874-90-8
Formula C8H7NOMW 133.15Research-use catalog entryCOA/SDS by request

4-Methoxybenzonitrile

CAS Number: 874-90-8

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Available options

Available Options

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Loading RDKit molecule structure...
InChIKey: XDJAAZYHCCRJOK-UHFFFAOYSA-NC8H7NO | MW 133.15

Chemical Absolute Identifiers

CAS Number

874-90-8

PubChem CID

70129

Molecular Formula

C8H7NO

Molecular Weight

133.15 g/mol

Exact Mass

133.052764

InChIKey

XDJAAZYHCCRJOK-UHFFFAOYSA-N

SMILES String

COC1=CC=C(C=C1)C#N

Physical Properties

No physical property values available.

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Vapor Pressure

Estimated value, unit not specified

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

Catalog Facts

Structural features

4-Methoxybenzonitrile (CAS 874-90-8) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C8H7NO and molecular weight 133. 15 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; structure-derived tags include nitrogen-containing heterocycle.

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

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, nitrogen oxides.

Disposal

  • Dispose of remaining and non-recyclable solutions to a licensed company.
  • Contact a professional agency with a waste disposal license to handle this substance.
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Fire Fighting

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

Accidental Release

  • Do not generate dust when collecting and disposing.
  • Sweep and shovel up.

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

4-Methoxybenzonitrile

Names & Synonyms

Benzonitrile, 4-methoxy-p-Methoxybenzonitrilepara-methoxybenzonitrileAnisonitrilep-Anisonitrile
Show all synonyms
4-anisonitrile4-Cyanoanisolep-Cyanoanisolep-Anisylnitrilep-Methoxyphenyl cyanide4-methoxybenzenecarbonitrile4-methoxy benzonitrile4-methoxy-benzonitrile1-Cyano-4-methoxybenzeneanisnitrileanisonitril4-Methoxybenzonitril1-methoxy-4-cyano-benzeneNCIOpen2_000576
External Identifiers
EC NUMBER: 212-871-6DSSTOX SUBSTANCE ID: DTXSID0052596CHEMBL ID: CHEMBL482278WIKIDATA ID: Q72443446Fr14437
Experimental Spectrum References
13C NMR Spectra15N NMR Spectra1D NMR Spectra1H NMR SpectraATR-IR SpectraFTIR SpectraNear IR Spectra — Prof. Buback, University of Goettingen, GermanyRaman SpectraVapor Phase IR Spectra
Literature & Patent References
DOI 10.1021/jm701549sToward prediction of alkane/water partition coefficients.PMID 18558667Toward prediction of alkane/water partition coefficients.

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

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 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 874-90-8

What are the key identifiers for 4-Methoxybenzonitrile (CAS 874-90-8)?

4-Methoxybenzonitrile is identified by CAS 874-90-8, with molecular formula C8H7NO, molecular weight 133.15, InChIKey XDJAAZYHCCRJOK-UHFFFAOYSA-N.

Can I request a COA for CAS 874-90-8?

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

Can I request supplier SDS for 4-Methoxybenzonitrile?

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

Is CAS 874-90-8 available for quotation?

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

Can MolGraph support bulk sourcing or custom synthesis review?

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