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Home/Compounds/CAS 100-21-0
Formula C8H6O4MW 166.13Research-use catalog entryCOA/SDS by request

Terephthalic Acid

CAS Number: 100-21-0

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Available Options

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1 kg
Purity
95%
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100 g
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Loading RDKit molecule structure...
InChIKey: KKEYFWRCBNTPAC-UHFFFAOYSA-NC8H6O4 | MW 166.13

Chemical Absolute Identifiers

CAS Number

100-21-0

PubChem CID

7489

Molecular Formula

C8H6O4

Molecular Weight

166.13 g/mol

Exact Mass

166.026609

InChIKey

KKEYFWRCBNTPAC-UHFFFAOYSA-N

SMILES String

C1=CC(=CC=C1C(=O)O)C(=O)O

Physical Properties

Appearance

Terephthalic acid is a white powder. (NTP, 1992)

Boiling Point

300.0 °C

Flash Point

260.0 °C

pKa

1

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

Catalog Facts

Structural features

Terephthalic Acid (CAS 100-21-0) is listed in the Materials Science portfolio, with molecular formula C8H6O4 and molecular weight 166. 13 g/mol.

Sourcing context

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

Research use context

Intended for materials chemistry research and formulation screening workflows.

Documentation needs

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

Applications & Classification

Ligand ResearchMOF and COF MaterialsMaterials ScienceResearch 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: Thyrotropin receptor (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Thyrotropin receptor

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents · best pChEMBL 4.6

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.

Disposal

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

Terephthalic Acid

Names & Synonyms

p-Phthalic acid1,4-Benzenedicarboxylic acidbenzene-1,4-dicarboxylic acidp-Dicarboxybenzene1,4-dicarboxybenzene
Show all synonyms
Acide terephtaliquep-Benzenedicarboxylic acidp-Carboxybenzoic acidTephtholpara-Phthalic acidKyselina tereftalova4-Carboxybenzoic AcidWR 16262TA 124-oxoniocarbonylbenzoateP-PTHALIC ACIDp-PhthalateKyselina terftalovaBenzene-p-dicarboxylic acidHSDB 834
External Identifiers
EC NUMBER: 202-830-0EC NUMBER: 685-562-0DSSTOX SUBSTANCE ID: DTXSID6026080CHEMBL ID: CHEMBL1374420CHEBI ID: CHEBI:15702UNII: 6S7NKZ40BQHMDB ID: HMDB0002428ICSC NUMBER: 0330KEGG ID: C06337METABOLOMICS WORKBENCH ID: 38157
Experimental Spectrum References
13C NMR Spectra1H NMR SpectraATR-IR SpectraFTIR SpectraRaman Spectra
Literature & Patent References
DOI 10.1016/j.ejmech.2025.117280Progress in the development of macrophage migration inhibitory factor small-molecule inhibitors.PMID 39854942Progress in the development of macrophage migration inhibitory factor small-molecule inhibitors.DOI 10.6019/CHEMBL4495564Identification of inhibitors of SARS-Cov2 M-Pro enzymatic activity using a small molecule repurposing screenDOI 10.6019/CHEMBL4495565Cytopathic SARS-Cov2 screening on VERO-E6 cells in a large repurposing effortDOI 10.1016/j.bmc.2015.06.042Benzoic acid derivatives with improved antifungal activity: Design, synthesis, structure-activity relationship (SAR) and CYP53 docking studies.PMID 26154240Benzoic acid derivatives with improved antifungal activity: Design, synthesis, structure-activity relationship (SAR) and CYP53 docking studies.DOI 10.1016/j.bmc.2011.10.013Benzenepolycarboxylic acids with potential anti-hemorrhagic properties and structure-activity relationships.PMID 22047800Benzenepolycarboxylic acids with potential anti-hemorrhagic properties and structure-activity relationships.

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

Hexaphthalic acidCAS 1246015-46-2
1,3,5-Tris(4-carboxyphenyl)benzeneCAS 50446-44-1
4-(4-(3,5-Bis(4-(4-carboxyphenyl)phenyl)phenyl)phenyl)benzoic acidCAS 911818-75-2
3'',4'',5'',6''-Tetrakis(4'-carboxy[1,1'-biphenyl]-4-yl)[1,1':4',1'':2'',1''':4''',1''''-quinquephenyl]-4,4''''-dicarboxylic acidCAS 1374404-53-1
Tetrakis(4-carboxyphenyl)silaneCAS 10256-84-5

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 1246015-46-2Hexaphthalic acidCAS 50446-44-11,3,5-Tris(4-carboxyphenyl)benzeneCAS 911818-75-24-(4-(3,5-Bis(4-(4-carboxyphenyl)phenyl)phenyl)phenyl)benzoic acidCAS 1374404-53-13'',4'',5'',6''-Tetrakis(4'-carboxy[1,1'-biphenyl]-4-yl)[1,1':4',1'':2'',1''':4''',1''''-quinquephenyl]-4,4''''-dicarboxylic acidCAS 10256-84-5Tetrakis(4-carboxyphenyl)silaneCAS 59-67-6Nicotinic AcidCAS 98-98-6Picolinic acidCAS 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 acid

RFQ questions for CAS 100-21-0

What are the key identifiers for Terephthalic Acid (CAS 100-21-0)?

Terephthalic Acid is identified by CAS 100-21-0, with molecular formula C8H6O4, molecular weight 166.13, InChIKey KKEYFWRCBNTPAC-UHFFFAOYSA-N.

Does CAS 100-21-0 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Thyrotropin receptor. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 100-21-0?

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

Can I request supplier SDS for Terephthalic Acid?

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

Is CAS 100-21-0 available for quotation?

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

Can MolGraph support bulk sourcing or custom synthesis review?

Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.