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Home/Compounds/CAS 31719-77-4
Formula C8H7ClO2MW 170.59Research-use catalog entryCOA/SDS by request

3-(Chloromethyl)benzoic acid

CAS Number: 31719-77-4

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Loading RDKit molecule structure...
InChIKey: PBSUMBYSVFTMNG-UHFFFAOYSA-NC8H7ClO2 | MW 170.59

Chemical Absolute Identifiers

CAS Number

31719-77-4

PubChem CID

241752

Molecular Formula

C8H7ClO2

Molecular Weight

170.59 g/mol

Exact Mass

170.013457

InChIKey

PBSUMBYSVFTMNG-UHFFFAOYSA-N

SMILES String

O=C(O)c1cccc(CCl)c1

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

3-(Chloromethyl)benzoic acid (CAS 31719-77-4) is listed in the Advanced Chemicals portfolio, with molecular formula C8H7ClO2 and molecular weight 170. 59 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.

Documentation needs

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

Applications & Classification

Organic Building BlocksSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow

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

3-(Chloromethyl)benzoic acid

Names & Synonyms

InChI=1/C8H7ClO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5H2,(H,10,113-(Chloromethyl)benzoicAcid3-chloromethylbenzoic acidBenzoic acid, 3-(chloromethyl)-a-Chloro-m-toluic acid
Show all synonyms
3-Chloromethyl-benzoic acid3-(chloromethyl)-benzoic acidAC-907/25014203
External Identifiers
EC NUMBER: 627-977-1DSSTOX SUBSTANCE ID: DTXSID00287192CHEMBL ID: CHEMBL67150WIKIDATA ID: Q72453694
Experimental Spectrum References
13C NMR Spectra1D NMR Spectra1H NMR Spectra — Sigma-Aldrich Co. LLC.ATR-IR SpectraRaman Spectra
Literature & Patent References
DOI 10.1021/jm950589qComparative molecular moment analysis (CoMMA): 3D-QSAR without molecular superposition.PMID 8667357Comparative molecular moment analysis (CoMMA): 3D-QSAR without molecular superposition.DOI 10.1021/jm00072a012QSAR's from similarity matrices. Technique validation and application in the comparison of different similarity evaluation methods.PMID 8411009QSAR's from similarity matrices. Technique validation and application in the comparison of different similarity evaluation methods.

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-Chloromethyl-phenyl)-ethanoneCAS 41908-12-7
(3-Chloromethyl-phenyl)-acetic acidCAS 857165-45-8
Ethyl 3-(chloromethyl)benzoateCAS 54589-54-7
4-(Chloromethyl)benzoic acidCAS 1642-81-5
3-Chloromethyl-benzoic acid tert-butyl esterCAS 220510-74-7

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 41908-12-71-(3-Chloromethyl-phenyl)-ethanoneCAS 857165-45-8(3-Chloromethyl-phenyl)-acetic acidCAS 54589-54-7Ethyl 3-(chloromethyl)benzoateCAS 1642-81-54-(Chloromethyl)benzoic acidCAS 220510-74-73-Chloromethyl-benzoic acid tert-butyl esterCAS 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 acid

RFQ questions for CAS 31719-77-4

What are the key identifiers for 3-(Chloromethyl)benzoic acid (CAS 31719-77-4)?

3-(Chloromethyl)benzoic acid is identified by CAS 31719-77-4, with molecular formula C8H7ClO2, molecular weight 170.59, InChIKey PBSUMBYSVFTMNG-UHFFFAOYSA-N.

Can I request a COA for CAS 31719-77-4?

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

Can I request supplier SDS for 3-(Chloromethyl)benzoic acid?

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

Is CAS 31719-77-4 available for quotation?

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

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