structure of 54413-93-3

2-Iodo-5-Methoxybenzoic Acid(CAS 54413-93-3)

CAS No.: 54413-93-3 Brand: MolBest
M. Ft.: C8H7IO3 Cat. No: G5381105
M. Wt.: 278.04 MDL: MFCD00204590
Storage: 2-8°C Use: For laboratory research use only
HS CODE: 2918990090
Purity Grade Package Stock Price Quantity
98%
Documents:COANMRHPLCSDS
RG 1G In Stock 4 USD
98%
Documents:COANMRHPLCSDS
RG 5G In Stock 8 USD
98%
Documents:COANMRHPLCSDS
RG 25G In Stock 34 USD
98%
Documents:COANMRHPLCSDS
RG 100G In Stock 113 USD
99%
Documents:COANMRHPLCSDS
RG 1G In Stock 3 USD
99%
Documents:COANMRHPLCSDS
RG 5G In Stock 9 USD
99%
Documents:COANMRHPLCSDS
RG 25G In Stock 41 USD
99%
Documents:COANMRHPLCSDS
RG 100G In Stock 135 USD
99%
Documents:COANMRHPLCSDS
RG 500G In Stock 1238 USD
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Applications of 54413-93-3

Industry Application Process
Pharmaceutical Intermediates Key intermediate in the synthesis of anticancer agents (e.g., EGFR inhibitors) Used as an aryl iodide in palladium-catalyzed cross-coupling reactions (e.g., Suzuki or Heck reactions) to construct the target molecular scaffold
Organic Synthesis Used to prepare iodinated aromatic heterocycles and functionalized benzoic acid derivatives Subjected to multi-step modifications—including esterification, reduction, and halogen exchange—or employed directly in the preparation of organometallic reagents (e.g., Grignard reagents)
Materials Science Structural precursor for liquid crystal monomers and organic optoelectronic materials Undergoes subsequent C–N or C–O bond coupling via the iodine atom to introduce conjugated side chains, thereby tuning molecular energy levels and self-assembly properties

Physical and chemical properties of 54413-93-3

Acidity coefficient

2.74±0.10(Predicted)

Boiling Point

351.2±32.0 °C at 760 mmHg

Density

1.9±0.1 g/cm3

Exact Mass

277.943970

Flash Point

166.2±25.1 °C

Index of Refraction

1.631

LogP

2.51

Melting Point

136-137 °C

Molecular Formula

C8H7IO3

Molecular Weight

278.044

PSA

46.53000

Storage condition

2-8°C

Vapour Pressure

0.0±0.8 mmHg at 25°C

Spectrums of 54413-93-3

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 54413-93-3

Retrosynthesis analysis of 54413-93-3


Q&A for CAS 54413-93-3

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Download SDS of 54413-93-3

Pictograms

Signal Word

Warning

Hazard Statements

H302 Harmful if swallowed
H315 Causes skin irritation
H319 Causes serious eye irritation
H335 May cause respiratory irritation

Safety Data Sheet

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Operate under the ISO 9001 system