structure of 4546-95-6

1H-1,2,3-Triazole-4,5-Dicarboxylic Acid(CAS 4546-95-6)

CAS No.: 4546-95-6 Brand: MolBest
M. Ft.: C4H3N3O4 Cat. No: G9429494
M. Wt.: 157.08 MDL: MFCD00005246
Storage: 2-8°C Use: For laboratory research use only
HS CODE: 2933990090
Purity Grade Package Stock Price Quantity
98%
Documents:COANMRHPLCSDS
RG 100MG In Stock 3 USD
98%
Documents:COANMRHPLCSDS
RG 5G In Stock 79 USD
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Physical and chemical properties of 4546-95-6

Acidity coefficient

pK1:1.86;pK2:5.90;pK3:9.30 (25°C)

Boiling Point

587.9ºC at 760 mmHg

Density

1.981g/cm3

Exact Mass

157.01200

Flash Point

309.3ºC

H Bond Acceptors

6

H Bond Donors

3

Index of Refraction

1.702

LogP

-0.482428768

Melting Point

200ºC (dec.)(lit.)

Molecular Formula

C4H3N3O4

Molecular Weight

157.08400

PSA

116.17000

Storage condition

2-8°C

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Spectrums of 4546-95-6

Attention:
1.The NMR spectrum displayed on the page is a pre-sale reference spectrum and may differ from that of the actual received batch.
2.The accompanying documentation will include the NMR spectrum and purity analysis data for the shipped batch.
Physical sample testing spectrum (NMR) of 4546-95-6

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Hazard Statements

H315 Causes skin irritation
H319 Causes serious eye irritation
H335 May cause respiratory irritation

Safety Data Sheet

Q&A for CAS 4546-95-6

1. How can I verify product quality?
Every batch is tested in accordance with ISO 9001 requirements. We provide a Certificate of Analysis (COA), NMR spectrum, purity report, and test methods with each shipment. Third-party retesting is supported, and we offer a full refund if our data is incorrect.

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Applications of 4546-95-6

The unique properties of 1H-1,2,3-triazole-4,5-dicarboxylic acid have led to diverse applications:

  • Pharmaceuticals: Its derivatives are explored for drug development due to their biological activities.
  • Coordination Polymers: It serves as a ligand in the formation of metal-organic frameworks and coordination complexes.
  • Agricultural Chemicals: Potential use as agrochemicals due to its antimicrobial properties.

Retrosynthesis analysis of 4546-95-6

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